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

Systemtic Name: ethyl N-[N-[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-piperidin-1-yl-carbonimidoyl]carbamate Openeye Name: ethyl N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-C-(1-piperidyl)carbonimidoyl]carbamate CAS Name: N-[[1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]imino-(1-piperidinyl)methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[N-[1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-C-piperidin-1-ylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]-C-piperidino-carbonimidoyl]carbamic acid ethyl ester Formula: C25H42N6O3 MolecularWeight: 474.63938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C)C#N)N3CCCCC3

Isomeric SMILES

CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C)C#N)N3CCCCC3

InChI

InChI=1S/C25H42N6O3/c1-3-34-24(33)28-23(31-14-8-5-9-15-31)27-21(18-20-10-6-4-7-11-20)22(32)29-25(19-26)12-16-30(2)17-13-25/h20-21H,3-18H2,1-2H3,(H,29,32)(H,27,28,33)