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

Systemtic Name: methyl (2S)-2-[[5-(cyclohexylcarbamoyl)-1-cyclopropyl-4-oxidanylidene-pyridin-3-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: methyl (2S)-2-[[5-(cyclohexylcarbamoyl)-1-cyclopropyl-4-oxo-pyridine-3-carbonyl]amino]-2-phenyl-acetate CAS Name: (2S)-2-[[[5-[(cyclohexylamino)-oxomethyl]-1-cyclopropyl-4-oxo-3-pyridinyl]-oxomethyl]amino]-2-phenylacetic acid methyl ester IUPAC Name: methyl (2S)-2-[[5-(cyclohexylcarbamoyl)-1-cyclopropyl-4-oxopyridine-3-carbonyl]amino]-2-phenylacetate Traditional Name: (2S)-2-[[5-(cyclohexylcarbamoyl)-1-cyclopropyl-4-keto-nicotinoyl]amino]-2-phenyl-acetic acid methyl ester Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCC3)C4CC4

Isomeric SMILES

COC(=O)[C@H](C1=CC=CC=C1)NC(=O)C2=CN(C=C(C2=O)C(=O)NC3CCCCC3)C4CC4

InChI

InChI=1S/C25H29N3O5/c1-33-25(32)21(16-8-4-2-5-9-16)27-24(31)20-15-28(18-12-13-18)14-19(22(20)29)23(30)26-17-10-6-3-7-11-17/h2,4-5,8-9,14-15,17-18,21H,3,6-7,10-13H2,1H3,(H,26,30)(H,27,31)/t21-/m0/s1