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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NCC3=CC=CC=C3)Cl)S

Isomeric SMILES

CCCCN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NCC3=CC=CC=C3)Cl)S

InChI

InChI=1S/C20H22ClN5O3S2/c1-2-3-9-26-13-23-24-20(26)25-31(28,29)18-10-15(16(21)11-17(18)30)19(27)22-12-14-7-5-4-6-8-14/h4-8,10-11,13,30H,2-3,9,12H2,1H3,(H,22,27)(H,24,25)