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

Systemtic Name: N-[[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxy-benzamide Openeye Name: N-[[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[[4-[(3,4-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-[[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-hexoxybenzamide Traditional Name: N-[[4-[(3,4-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C28H33N3O4S2 MolecularWeight: 539.70932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C28H33N3O4S2/c1-4-5-6-7-18-35-25-14-9-22(10-15-25)27(32)30-28(36)29-23-12-16-26(17-13-23)37(33,34)31-24-11-8-20(2)21(3)19-24/h8-17,19,31H,4-7,18H2,1-3H3,(H2,29,30,32,36)