2-[4-cyano-1-(phenylmethyl)piperidin-4-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide

Systemtic Name: 2-[4-cyano-1-(phenylmethyl)piperidin-4-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide Openeye Name: 2-(1-benzyl-4-cyano-4-piperidyl)-2-(cyclohexylmethyl)-4-morpholino-4-oxo-butanamide CAS Name: 2-[4-cyano-1-(phenylmethyl)-4-piperidinyl]-2-(cyclohexylmethyl)-4-(4-morpholinyl)-4-oxobutanamide IUPAC Name: 2-(1-benzyl-4-cyanopiperidin-4-yl)-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxobutanamide Traditional Name: 2-(1-benzyl-4-cyano-4-piperidyl)-2-(cyclohexylmethyl)-4-keto-4-morpholino-butyramide Formula: C28H40N4O3 MolecularWeight: 480.6422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)N2CCOCC2)(C(=O)N)C3(CCN(CC3)CC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)N2CCOCC2)(C(=O)N)C3(CCN(CC3)CC4=CC=CC=C4)C#N

InChI

InChI=1S/C28H40N4O3/c29-22-27(11-13-31(14-12-27)21-24-9-5-2-6-10-24)28(26(30)34,19-23-7-3-1-4-8-23)20-25(33)32-15-17-35-18-16-32/h2,5-6,9-10,23H,1,3-4,7-8,11-21H2,(H2,30,34)