ethyl N-[N-[1-[[4-cyano-1-(1-phenylethyl)piperidin-4-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate

Systemtic Name: ethyl N-[N-[1-[[4-cyano-1-(1-phenylethyl)piperidin-4-yl]amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate Openeye Name: ethyl N-[N-[2-[[4-cyano-1-(1-phenylethyl)-4-piperidyl]amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-C-morpholino-carbonimidoyl]carbamate CAS Name: N-[[1-[[4-cyano-1-(1-phenylethyl)-4-piperidinyl]amino]-3-cyclohexyl-1-oxopropan-2-yl]imino-(4-morpholinyl)methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[N-[1-[[4-cyano-1-(1-phenylethyl)piperidin-4-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-C-morpholin-4-ylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[[4-cyano-1-(1-phenylethyl)-4-piperidyl]amino]-1-(cyclohexylmethyl)-2-keto-ethyl]-C-morpholino-carbonimidoyl]carbamic acid ethyl ester Formula: C31H46N6O4 MolecularWeight: 566.73474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C(C)C3=CC=CC=C3)C#N)N4CCOCC4

Isomeric SMILES

CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C(C)C3=CC=CC=C3)C#N)N4CCOCC4

InChI

InChI=1S/C31H46N6O4/c1-3-41-30(39)34-29(37-18-20-40-21-19-37)33-27(22-25-10-6-4-7-11-25)28(38)35-31(23-32)14-16-36(17-15-31)24(2)26-12-8-5-9-13-26/h5,8-9,12-13,24-25,27H,3-4,6-7,10-11,14-22H2,1-2H3,(H,35,38)(H,33,34,39)