4-chloranyl-N-[1-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide Openeye Name: 4-chloro-N-[1-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide CAS Name: 4-chloro-N-[1-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-phenylethyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(4-methyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-phenylethyl]benzenesulfonamide Traditional Name: 4-chloro-N-[1-(4-methyl-5-thioxo-1H-1,2,4-triazol-3-yl)-2-phenyl-ethyl]benzenesulfonamide Formula: C17H17ClN4O2S2 MolecularWeight: 408.92548

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=NNC1=S)C(CC2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H17ClN4O2S2/c1-22-16(19-20-17(22)25)15(11-12-5-3-2-4-6-12)21-26(23,24)14-9-7-13(18)8-10-14/h2-10,15,21H,11H2,1H3,(H,20,25)