N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[4-[(3,5-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[4-[(3,5-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]-2-hexoxy-benzamide Formula: C28H33N3O4S2 MolecularWeight: 539.70932

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C28H33N3O4S2/c1-4-5-6-9-16-35-26-11-8-7-10-25(26)27(32)30-28(36)29-22-12-14-24(15-13-22)37(33,34)31-23-18-20(2)17-21(3)19-23/h7-8,10-15,17-19,31H,4-6,9,16H2,1-3H3,(H2,29,30,32,36)