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Triazoles

Organic heterocyclic compounds that consist of a five-membered ring made up of two carbon atoms and three nitrogen atoms.

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1

WP 155, TRC

CAS: 1031-47-6 Molecular Formula: C12 H19 N6 O P Molecular Weight (g/mol): 294.29 Synonym: P-(5-Amino-3-phenyl-1H-1,2,4-triazol-1-yl)-N,N,N',N'-tetramethylphosphonic diamide,5-Amino-1-[bis(dimethylamino)phosphinyl]-3-phenyl-1,2,4-triazole,5-Amino-1-bis(dimethylamido)phosphoryl-3-phenyl-1,2,4-triazole,5-Amino-3-phenyl-1,2,4-triazol-1-yl-N,N,N',N'-tetramethylphosphodiamide,NSC 232670,Triamiphos,WP 155,Wepsyn,Wepsyn 155 IUPAC Name: 2-[bis(dimethylamino)phosphoryl]-5-phenyl-1,2,4-triazol-3-amine SMILES: CN(C)P(=O)(N(C)C)n1nc(nc1N)c2ccccc2

CAS 1031-47-6
Molecular Weight (g/mol) 294.29
SMILES CN(C)P(=O)(N(C)C)n1nc(nc1N)c2ccccc2
Synonym P-(5-Amino-3-phenyl-1H-1,2,4-triazol-1-yl)-N,N,N',N'-tetramethylphosphonic diamide,5-Amino-1-[bis(dimethylamino)phosphinyl]-3-phenyl-1,2,4-triazole,5-Amino-1-bis(dimethylamido)phosphoryl-3-phenyl-1,2,4-triazole,5-Amino-3-phenyl-1,2,4-triazol-1-yl-N,N,N',N'-tetramethylphosphodiamide,NSC 232670,Triamiphos,WP 155,Wepsyn,Wepsyn 155
IUPAC Name 2-[bis(dimethylamino)phosphoryl]-5-phenyl-1,2,4-triazol-3-amine
Molecular Formula C12 H19 N6 O P
2

Triazophos 85%, TRC

CAS: 24017-47-8 Molecular Formula: C12 H16 N3 O3 P S Molecular Weight (g/mol): 313.31 Synonym: Phosphorothioic acid, O,O-diethyl O-(1-phenyl-1H-1,2,4-triazol-3-yl) ester,1H-1,2,4-Triazol-3-ol, 1-phenyl-, O-ester with O,O-diethyl phosphorothioate (8CI),1-Phenyl-3-(O,O-diethylthionophosphoryl)-1,2,4-triazole,HOE 2960,Hostathion,Hostathion 40EC,Hostation,Triazofos,Triazophos IUPAC Name: diethoxy-[(1-phenyl-1,2,4-triazol-3-yl)oxy]-sulfanylidene-λ^{5}-phosphane SMILES: CCOP(=S)(OCC)Oc1ncn(n1)c2ccccc2

CAS 24017-47-8
Molecular Weight (g/mol) 313.31
SMILES CCOP(=S)(OCC)Oc1ncn(n1)c2ccccc2
Synonym Phosphorothioic acid, O,O-diethyl O-(1-phenyl-1H-1,2,4-triazol-3-yl) ester,1H-1,2,4-Triazol-3-ol, 1-phenyl-, O-ester with O,O-diethyl phosphorothioate (8CI),1-Phenyl-3-(O,O-diethylthionophosphoryl)-1,2,4-triazole,HOE 2960,Hostathion,Hostathion 40EC,Hostation,Triazofos,Triazophos
IUPAC Name diethoxy-[(1-phenyl-1,2,4-triazol-3-yl)oxy]-sulfanylidene-λ^{5}-phosphane
Molecular Formula C12 H16 N3 O3 P S
3

3-Desmethyl Sulfentrazone, TRC

CAS: 134391-02-9 Molecular Formula: C10 H8 Cl2 F2 N4 O3 S Molecular Weight (g/mol): 373.16 Synonym: Methanesulfonamide, N-[2,4-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]-,N-[2,4-Dichloro-5-[4-(difluoromethyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]methanesulfonamide IUPAC Name: N-[2,4-dichloro-5-[4-(difluoromethyl)-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide SMILES: CS(=O)(=O)Nc1cc(N2N=CN(C(F)F)C2=O)c(Cl)cc1Cl

CAS 134391-02-9
Molecular Weight (g/mol) 373.16
SMILES CS(=O)(=O)Nc1cc(N2N=CN(C(F)F)C2=O)c(Cl)cc1Cl
Synonym Methanesulfonamide, N-[2,4-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]-,N-[2,4-Dichloro-5-[4-(difluoromethyl)-4,5-dihydro-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
IUPAC Name N-[2,4-dichloro-5-[4-(difluoromethyl)-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
Molecular Formula C10 H8 Cl2 F2 N4 O3 S
4

4-Defluoro-4-(1H-1,2,4-triazol-1-yl) Fluconazole, TRC

CAS: 871550-15-1 Molecular Formula: C15 H14 F N9 O Molecular Weight (g/mol): 355.33 Synonym: 2-[2-Fluoro-4-(1H-1,2,4-triazol-1-yl)phenyl]-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol,Fluconazole Imp. B (EP) IUPAC Name: 2-[2-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: OC(Cn1cncn1)(Cn2cncn2)c3ccc(cc3F)n4cncn4

CAS 871550-15-1
Molecular Weight (g/mol) 355.33
SMILES OC(Cn1cncn1)(Cn2cncn2)c3ccc(cc3F)n4cncn4
Synonym 2-[2-Fluoro-4-(1H-1,2,4-triazol-1-yl)phenyl]-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol,Fluconazole Imp. B (EP)
IUPAC Name 2-[2-fluoro-4-(1,2,4-triazol-1-yl)phenyl]-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
Molecular Formula C15 H14 F N9 O
5

Sulfentrazone, TRC

CAS: 122836-35-5 Molecular Formula: C11 H10 Cl2 F2 N4 O3 S Molecular Weight (g/mol): 387.19 Synonym: Flucarbazone-N-desmethyl,N-[2,4-Dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]methanesulfonamide (ACI),2',4'-Dichloro-5'-(4-difluoromethyl-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl)methanesulfonanilide,Authority,Authority 75DF,Blanket,Boral,Capaz,Dismiss,F 6285,Spartan,Sulfentrazone,Methanesulfonamide, N-[2,4-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]- (9CI, ACI) IUPAC Name: N-[2,4-dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide SMILES: CC1=NN(C(=O)N1C(F)F)c2cc(NS(=O)(=O)C)c(Cl)cc2Cl

CAS 122836-35-5
Molecular Weight (g/mol) 387.19
SMILES CC1=NN(C(=O)N1C(F)F)c2cc(NS(=O)(=O)C)c(Cl)cc2Cl
Synonym Flucarbazone-N-desmethyl,N-[2,4-Dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]methanesulfonamide (ACI),2',4'-Dichloro-5'-(4-difluoromethyl-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl)methanesulfonanilide,Authority,Authority 75DF,Blanket,Boral,Capaz,Dismiss,F 6285,Spartan,Sulfentrazone,Methanesulfonamide, N-[2,4-dichloro-5-[4-(difluoromethyl)-4,5-dihydro-3-methyl-5-oxo-1H-1,2,4-triazol-1-yl]phenyl]- (9CI, ACI)
IUPAC Name N-[2,4-dichloro-5-[4-(difluoromethyl)-3-methyl-5-oxo-1,2,4-triazol-1-yl]phenyl]methanesulfonamide
Molecular Formula C11 H10 Cl2 F2 N4 O3 S
6

1,1'-(1,3-Phenylene)bis-1H-1,2,4-triazole, TRC

CAS: 514222-44-7 Molecular Formula: C10 H8 N6 Molecular Weight (g/mol): 212.21 Synonym: 1,1'-(1,3-Phenylene)di-1H-1,2,4-triazole,Fluconazole Imp. C (EP) IUPAC Name: 1-[3-(1,2,4-triazol-1-yl)phenyl]-1,2,4-triazole SMILES: c1cc(cc(c1)n2cncn2)n3cncn3

CAS 514222-44-7
Molecular Weight (g/mol) 212.21
SMILES c1cc(cc(c1)n2cncn2)n3cncn3
Synonym 1,1'-(1,3-Phenylene)di-1H-1,2,4-triazole,Fluconazole Imp. C (EP)
IUPAC Name 1-[3-(1,2,4-triazol-1-yl)phenyl]-1,2,4-triazole
Molecular Formula C10 H8 N6