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

Systemtic Name: N-[1-[[3-cyano-1-(phenylmethyl)azetidin-3-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]morpholine-4-carboxamide Openeye Name: N-[2-[(1-benzyl-3-cyano-azetidin-3-yl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]morpholine-4-carboxamide CAS Name: N-[1-[[3-cyano-1-(phenylmethyl)-3-azetidinyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-4-morpholinecarboxamide IUPAC Name: N-[1-[(1-benzyl-3-cyanoazetidin-3-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]morpholine-4-carboxamide Traditional Name: N-[2-[(1-benzyl-3-cyano-azetidin-3-yl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]morpholine-4-carboxamide Formula: C25H35N5O3 MolecularWeight: 453.5771

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NC2(CN(C2)CC3=CC=CC=C3)C#N)NC(=O)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NC2(CN(C2)CC3=CC=CC=C3)C#N)NC(=O)N4CCOCC4

InChI

InChI=1S/C25H35N5O3/c26-17-25(18-29(19-25)16-21-9-5-2-6-10-21)28-23(31)22(15-20-7-3-1-4-8-20)27-24(32)30-11-13-33-14-12-30/h2,5-6,9-10,20,22H,1,3-4,7-8,11-16,18-19H2,(H,27,32)(H,28,31)