4-[(4-carbamothioylphenyl)carbonylamino]-3-[(3,4-dimethoxyphenyl)carbonylamino]benzoic acid

Systemtic Name: 4-[(4-carbamothioylphenyl)carbonylamino]-3-[(3,4-dimethoxyphenyl)carbonylamino]benzoic acid Openeye Name: 4-[(4-carbamothioylbenzoyl)amino]-3-[(3,4-dimethoxybenzoyl)amino]benzoic acid CAS Name: 4-[[(4-carbamothioylphenyl)-oxomethyl]amino]-3-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(4-carbamothioylbenzoyl)amino]-3-[(3,4-dimethoxybenzoyl)amino]benzoic acid Traditional Name: 4-[(4-thiocarbamoylbenzoyl)amino]-3-(veratroylamino)benzoic acid Formula: C24H21N3O6S MolecularWeight: 479.50504

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)C(=S)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)C(=S)N)OC

InChI

InChI=1S/C24H21N3O6S/c1-32-19-10-8-15(12-20(19)33-2)23(29)27-18-11-16(24(30)31)7-9-17(18)26-22(28)14-5-3-13(4-6-14)21(25)34/h3-12H,1-2H3,(H2,25,34)(H,26,28)(H,27,29)(H,30,31)