N-[3-cyano-1-(1-phenylethyl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide

Systemtic Name: N-[3-cyano-1-(1-phenylethyl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxidanylidene-butanamide Openeye Name: N-[3-cyano-1-(1-phenylethyl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholino-4-oxo-butanamide CAS Name: N-[3-cyano-1-(1-phenylethyl)-3-pyrrolidinyl]-2-(cyclohexylmethyl)-4-(4-morpholinyl)-4-oxobutanamide IUPAC Name: N-[3-cyano-1-(1-phenylethyl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-morpholin-4-yl-4-oxobutanamide Traditional Name: N-[3-cyano-1-(1-phenylethyl)pyrrolidin-3-yl]-2-(cyclohexylmethyl)-4-keto-4-morpholino-butyramide Formula: C28H40N4O3 MolecularWeight: 480.6422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCC(C2)(C#N)NC(=O)C(CC3CCCCC3)CC(=O)N4CCOCC4

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCC(C2)(C#N)NC(=O)C(CC3CCCCC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C28H40N4O3/c1-22(24-10-6-3-7-11-24)32-13-12-28(20-29,21-32)30-27(34)25(18-23-8-4-2-5-9-23)19-26(33)31-14-16-35-17-15-31/h3,6-7,10-11,22-23,25H,2,4-5,8-9,12-19,21H2,1H3,(H,30,34)