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

Systemtic Name: ethyl N-[N-[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-phenyl-carbonimidoyl]carbamate Openeye Name: ethyl N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-C-phenyl-carbonimidoyl]carbamate CAS Name: N-[[1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]imino-phenylmethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[N-[1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-C-phenylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]-C-phenyl-carbonimidoyl]carbamic acid ethyl ester Formula: C26H37N5O3 MolecularWeight: 467.60368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37N5O3/c1-3-34-25(33)29-23(21-12-8-5-9-13-21)28-22(18-20-10-6-4-7-11-20)24(32)30-26(19-27)14-16-31(2)17-15-26/h5,8-9,12-13,20,22H,3-4,6-7,10-11,14-18H2,1-2H3,(H,30,32)(H,28,29,33)