4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide Openeye Name: 4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-propyl]benzenesulfonamide CAS Name: 4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-1-phenylpropyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpropyl]benzenesulfonamide Traditional Name: 4-methyl-N-[3-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-1-phenyl-propyl]benzenesulfonamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC2=NNC(=N2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC2=NNC(=N2)C)C3=CC=CC=C3

InChI

InChI=1S/C19H22N4O2S2/c1-14-8-10-17(11-9-14)27(24,25)23-18(16-6-4-3-5-7-16)12-13-26-19-20-15(2)21-22-19/h3-11,18,23H,12-13H2,1-2H3,(H,20,21,22)