methyl 3-[(4-carbamothioylphenyl)carbonylamino]-4-[(4-methoxyphenyl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(4-carbamothioylphenyl)carbonylamino]-4-[(4-methoxyphenyl)carbonylamino]benzoate Openeye Name: methyl 3-[(4-carbamothioylbenzoyl)amino]-4-[(4-methoxybenzoyl)amino]benzoate CAS Name: 3-[[(4-carbamothioylphenyl)-oxomethyl]amino]-4-[[(4-methoxyphenyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-carbamothioylbenzoyl)amino]-4-[(4-methoxybenzoyl)amino]benzoate Traditional Name: 4-(p-anisoylamino)-3-[(4-thiocarbamoylbenzoyl)amino]benzoic acid methyl ester Formula: C24H21N3O5S MolecularWeight: 463.50564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O5S/c1-31-18-10-7-16(8-11-18)22(28)26-19-12-9-17(24(30)32-2)13-20(19)27-23(29)15-5-3-14(4-6-15)21(25)33/h3-13H,1-2H3,(H2,25,33)(H,26,28)(H,27,29)