N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]hexanamide

Systemtic Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]hexanamide Openeye Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]hexanamide CAS Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]hexanamide IUPAC Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]hexanamide Traditional Name: N-[[4-[(2,6-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]hexanamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC=C2C)C

Isomeric SMILES

CCCCCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=CC=C2C)C

InChI

InChI=1S/C21H27N3O3S2/c1-4-5-6-10-19(25)23-21(28)22-17-11-13-18(14-12-17)29(26,27)24-20-15(2)8-7-9-16(20)3/h7-9,11-14,24H,4-6,10H2,1-3H3,(H2,22,23,25,28)