[(2S)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate

Systemtic Name: [(2S)-1-[(4-morpholin-4-ylsulfonylphenyl)amino]-1-oxidanylidene-propan-2-yl] pyridine-3-carboxylate Openeye Name: [(1S)-1-methyl-2-(4-morpholinosulfonylanilino)-2-oxo-ethyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [(2S)-1-[4-(4-morpholinylsulfonyl)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-morpholin-4-ylsulfonylanilino)-1-oxopropan-2-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [(1S)-2-keto-1-methyl-2-(4-morpholinosulfonylanilino)ethyl] ester Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CN=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C19H21N3O6S/c1-14(28-19(24)15-3-2-8-20-13-15)18(23)21-16-4-6-17(7-5-16)29(25,26)22-9-11-27-12-10-22/h2-8,13-14H,9-12H2,1H3,(H,21,23)/t14-/m0/s1