4-chloranyl-5-methyl-N-(5-oxidanylidene-4-phenyl-1H-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-5-methyl-N-(5-oxidanylidene-4-phenyl-1H-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide Openeye Name: 4-chloro-5-methyl-N-(5-oxo-4-phenyl-1H-1,2,4-triazol-3-yl)-2-sulfanyl-benzenesulfonamide CAS Name: 4-chloro-2-mercapto-5-methyl-N-(5-oxo-4-phenyl-1H-1,2,4-triazol-3-yl)benzenesulfonamide IUPAC Name: 4-chloro-5-methyl-N-(5-oxo-4-phenyl-1H-1,2,4-triazol-3-yl)-2-sulfanylbenzenesulfonamide Traditional Name: 4-chloro-N-(5-keto-4-phenyl-1H-1,2,4-triazol-3-yl)-2-mercapto-5-methyl-benzenesulfonamide Formula: C15H13ClN4O3S2 MolecularWeight: 396.87172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=O)N2C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)S)S(=O)(=O)NC2=NNC(=O)N2C3=CC=CC=C3

InChI

InChI=1S/C15H13ClN4O3S2/c1-9-7-13(12(24)8-11(9)16)25(22,23)19-14-17-18-15(21)20(14)10-5-3-2-4-6-10/h2-8,24H,1H3,(H,17,19)(H,18,21)