3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C26H29N3O4S2 MolecularWeight: 511.65616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C26H29N3O4S2/c1-4-5-13-33-23-8-6-7-20(17-23)25(30)28-26(34)27-21-9-11-24(12-10-21)35(31,32)29-22-15-18(2)14-19(3)16-22/h6-12,14-17,29H,4-5,13H2,1-3H3,(H2,27,28,30,34)