methyl (2S)-2-[[5-(2-methylpropylcarbamoyl)-4-oxidanylidene-1-propan-2-yl-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: methyl (2S)-2-[[5-(2-methylpropylcarbamoyl)-4-oxidanylidene-1-propan-2-yl-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[5-(isobutylcarbamoyl)-1-isopropyl-4-oxo-pyridine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[5-[(2-methylpropylamino)-oxomethyl]-4-oxo-1-propan-2-yl-3-pyridinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(2-methylpropylcarbamoyl)-4-oxo-1-propan-2-ylpyridine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[5-(isobutylcarbamoyl)-1-isopropyl-4-keto-nicotinoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C23H29N3O5 MolecularWeight: 427.49346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(C=C(C1=O)C(=O)NC(C2=CC=CC=C2)C(=O)OC)C(C)C

Isomeric SMILES

CC(C)CNC(=O)C1=CN(C=C(C1=O)C(=O)N[C@@H](C2=CC=CC=C2)C(=O)OC)C(C)C

InChI

InChI=1S/C23H29N3O5/c1-14(2)11-24-21(28)17-12-26(15(3)4)13-18(20(17)27)22(29)25-19(23(30)31-5)16-9-7-6-8-10-16/h6-10,12-15,19H,11H2,1-5H3,(H,24,28)(H,25,29)/t19-/m0/s1