propan-2-yl 2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylpyridine-3-carboxylate

Systemtic Name: propan-2-yl 2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylpyridine-3-carboxylate Openeye Name: isopropyl 2-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanylpyridine-3-carboxylate CAS Name: 2-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-3-pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylpyridine-3-carboxylate Traditional Name: 2-[(2-cumidino-2-keto-ethyl)thio]nicotinic acid isopropyl ester Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)OC(C)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CSC2=C(C=CC=N2)C(=O)OC(C)C

InChI

InChI=1S/C20H24N2O3S/c1-13(2)15-7-9-16(10-8-15)22-18(23)12-26-19-17(6-5-11-21-19)20(24)25-14(3)4/h5-11,13-14H,12H2,1-4H3,(H,22,23)