N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide

Systemtic Name: N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[4-[(2,4-dimethylphenyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[[4-[(2,4-dimethylphenyl)sulfamoyl]phenyl]thiocarbamoyl]benzamide Formula: C27H31N3O4S2 MolecularWeight: 525.68274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NC3=C(C=C(C=C3)C)C

InChI

InChI=1S/C27H31N3O4S2/c1-4-5-6-17-34-23-12-8-21(9-13-23)26(31)29-27(35)28-22-10-14-24(15-11-22)36(32,33)30-25-16-7-19(2)18-20(25)3/h7-16,18,30H,4-6,17H2,1-3H3,(H2,28,29,31,35)