N'-(2-azanyl-1-cyclopentyl-2-oxidanylidene-1-pyridin-4-yl-ethyl)-N-(5-methyl-1,2-oxazol-3-yl)-N'-(3-methylphenyl)butanediamide

Systemtic Name: N'-(2-azanyl-1-cyclopentyl-2-oxidanylidene-1-pyridin-4-yl-ethyl)-N-(5-methyl-1,2-oxazol-3-yl)-N'-(3-methylphenyl)butanediamide Openeye Name: N'-[2-amino-1-cyclopentyl-2-oxo-1-(4-pyridyl)ethyl]-N-(5-methylisoxazol-3-yl)-N'-(m-tolyl)butanediamide CAS Name: N'-(2-amino-1-cyclopentyl-2-oxo-1-pyridin-4-ylethyl)-N-(5-methyl-3-isoxazolyl)-N'-(3-methylphenyl)butanediamide IUPAC Name: N'-(2-amino-1-cyclopentyl-2-oxo-1-pyridin-4-ylethyl)-N-(5-methyl-1,2-oxazol-3-yl)-N'-(3-methylphenyl)butanediamide Traditional Name: N'-[2-amino-1-cyclopentyl-2-keto-1-(4-pyridyl)ethyl]-N-(5-methylisoxazol-3-yl)-N'-(m-tolyl)succinamide Formula: C27H31N5O4 MolecularWeight: 489.56614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C(=O)CCC(=O)NC2=NOC(=C2)C)C(C3CCCC3)(C4=CC=NC=C4)C(=O)N

Isomeric SMILES

CC1=CC(=CC=C1)N(C(=O)CCC(=O)NC2=NOC(=C2)C)C(C3CCCC3)(C4=CC=NC=C4)C(=O)N

InChI

InChI=1S/C27H31N5O4/c1-18-6-5-9-22(16-18)32(25(34)11-10-24(33)30-23-17-19(2)36-31-23)27(26(28)35,20-7-3-4-8-20)21-12-14-29-15-13-21/h5-6,9,12-17,20H,3-4,7-8,10-11H2,1-2H3,(H2,28,35)(H,30,31,33)