5-[(4-butan-2-yl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloranyl-N-(4-methylphenyl)-4-sulfanyl-benzamide

Systemtic Name: 5-[(4-butan-2-yl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloranyl-N-(4-methylphenyl)-4-sulfanyl-benzamide Openeye Name: 2-chloro-N-(p-tolyl)-5-[(4-sec-butyl-1,2,4-triazol-3-yl)sulfamoyl]-4-sulfanyl-benzamide CAS Name: 5-[(4-butan-2-yl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-4-mercapto-N-(4-methylphenyl)benzamide IUPAC Name: 5-[(4-butan-2-yl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-N-(4-methylphenyl)-4-sulfanylbenzamide Traditional Name: 2-chloro-4-mercapto-N-(p-tolyl)-5-[(4-sec-butyl-1,2,4-triazol-3-yl)sulfamoyl]benzamide Formula: C20H22ClN5O3S2 MolecularWeight: 480.00338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=C(C=C3)C)Cl)S

Isomeric SMILES

CCC(C)N1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC3=CC=C(C=C3)C)Cl)S

InChI

InChI=1S/C20H22ClN5O3S2/c1-4-13(3)26-11-22-24-20(26)25-31(28,29)18-9-15(16(21)10-17(18)30)19(27)23-14-7-5-12(2)6-8-14/h5-11,13,30H,4H2,1-3H3,(H,23,27)(H,24,25)