N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-(2-chlorophenyl)propanamide

Systemtic Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-(2-chlorophenyl)propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[4-(sec-butylsulfamoyl)phenyl]carbamothioyl]propanamide CAS Name: N-[[4-(butan-2-ylsulfamoyl)anilino]-sulfanylidenemethyl]-3-(2-chlorophenyl)propanamide IUPAC Name: N-[[4-(butan-2-ylsulfamoyl)phenyl]carbamothioyl]-3-(2-chlorophenyl)propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[4-(sec-butylsulfamoyl)phenyl]thiocarbamoyl]propionamide Formula: C20H24ClN3O3S2 MolecularWeight: 454.00586

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H24ClN3O3S2/c1-3-14(2)24-29(26,27)17-11-9-16(10-12-17)22-20(28)23-19(25)13-8-15-6-4-5-7-18(15)21/h4-7,9-12,14,24H,3,8,13H2,1-2H3,(H2,22,23,25,28)