N-[1-[(3-cyano-1-phenethyl-pyrrolidin-3-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide

Systemtic Name: N-[1-[(3-cyano-1-phenethyl-pyrrolidin-3-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[2-[(3-cyano-1-phenethyl-pyrrolidin-3-yl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[1-[(3-cyano-1-phenethyl-3-pyrrolidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-[(3-cyano-1-phenethylpyrrolidin-3-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[2-[(3-cyano-1-phenethyl-pyrrolidin-3-yl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]morpholine-4-carboxamide Formula: C27H39N5O3 MolecularWeight: 481.63026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CCC3=CC=CC=C3)C#N)NC(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CCN(C2)CCC3=CC=CC=C3)C#N)NC(=O)N4CCOCC4

InChI

InChI=1S/C27H39N5O3/c28-20-27(12-14-31(21-27)13-11-22-7-3-1-4-8-22)30-25(33)24(19-23-9-5-2-6-10-23)29-26(34)32-15-17-35-18-16-32/h1,3-4,7-8,23-24H,2,5-6,9-19,21H2,(H,29,34)(H,30,33)