N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H23N5O4S2 MolecularWeight: 461.55772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=O)CSC2=NNC(=O)N2CCC3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=O)CSC2=NNC(=O)N2CCC3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C20H23N5O4S2/c1-13-10-16(31(21,28)29)11-17(14(13)2)22-18(26)12-30-20-24-23-19(27)25(20)9-8-15-6-4-3-5-7-15/h3-7,10-11H,8-9,12H2,1-2H3,(H,22,26)(H,23,27)(H2,21,28,29)