methyl 5-[(4-carbamothioylphenyl)carbonylamino]-6-[(4-methoxyphenyl)carbonylamino]pyridine-3-carboxylate

Systemtic Name: methyl 5-[(4-carbamothioylphenyl)carbonylamino]-6-[(4-methoxyphenyl)carbonylamino]pyridine-3-carboxylate Openeye Name: methyl 5-[(4-carbamothioylbenzoyl)amino]-6-[(4-methoxybenzoyl)amino]pyridine-3-carboxylate CAS Name: 5-[[(4-carbamothioylphenyl)-oxomethyl]amino]-6-[[(4-methoxyphenyl)-oxomethyl]amino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-carbamothioylbenzoyl)amino]-6-[(4-methoxybenzoyl)amino]pyridine-3-carboxylate Traditional Name: 6-(p-anisoylamino)-5-[(4-thiocarbamoylbenzoyl)amino]nicotinic acid methyl ester Formula: C23H20N4O5S MolecularWeight: 464.4937

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=C(C=C(C=N2)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=N2)C(=O)OC)NC(=O)C3=CC=C(C=C3)C(=S)N

InChI

InChI=1S/C23H20N4O5S/c1-31-17-9-7-15(8-10-17)22(29)27-20-18(11-16(12-25-20)23(30)32-2)26-21(28)14-5-3-13(4-6-14)19(24)33/h3-12H,1-2H3,(H2,24,33)(H,26,28)(H,25,27,29)