methyl 6-[(4-carbamothioylphenyl)carbonylamino]-5-[(4-methoxyphenyl)sulfonylamino]pyridine-2-carboxylate

Systemtic Name: methyl 6-[(4-carbamothioylphenyl)carbonylamino]-5-[(4-methoxyphenyl)sulfonylamino]pyridine-2-carboxylate Openeye Name: methyl 6-[(4-carbamothioylbenzoyl)amino]-5-[(4-methoxyphenyl)sulfonylamino]pyridine-2-carboxylate CAS Name: 6-[[(4-carbamothioylphenyl)-oxomethyl]amino]-5-[(4-methoxyphenyl)sulfonylamino]-2-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(4-carbamothioylbenzoyl)amino]-5-[(4-methoxyphenyl)sulfonylamino]pyridine-2-carboxylate Traditional Name: 5-[(4-methoxyphenyl)sulfonylamino]-6-[(4-thiocarbamoylbenzoyl)amino]picolinic acid methyl ester Formula: C22H20N4O6S2 MolecularWeight: 500.5474

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N4O6S2/c1-31-15-7-9-16(10-8-15)34(29,30)26-17-11-12-18(22(28)32-2)24-20(17)25-21(27)14-5-3-13(4-6-14)19(23)33/h3-12,26H,1-2H3,(H2,23,33)(H,24,25,27)