[2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 2-azanylpyridine-3-carboxylate

Systemtic Name: [2-[(2-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 2-azanylpyridine-3-carboxylate Openeye Name: [2-(2-methylsulfonylanilino)-2-oxo-ethyl] 2-aminopyridine-3-carboxylate CAS Name: 2-amino-3-pyridinecarboxylic acid [2-(2-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylsulfonylanilino)-2-oxoethyl] 2-aminopyridine-3-carboxylate Traditional Name: 2-aminonicotinic acid [2-keto-2-(2-mesylanilino)ethyl] ester Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=C(N=CC=C2)N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NC(=O)COC(=O)C2=C(N=CC=C2)N

InChI

InChI=1S/C15H15N3O5S/c1-24(21,22)12-7-3-2-6-11(12)18-13(19)9-23-15(20)10-5-4-8-17-14(10)16/h2-8H,9H2,1H3,(H2,16,17)(H,18,19)