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

Systemtic Name: ethyl N-[N-[1-[(4-cyano-1-propyl-piperidin-4-yl)amino]-3-cycloheptyl-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate Openeye Name: ethyl N-[N-[2-[(4-cyano-1-propyl-4-piperidyl)amino]-1-(cycloheptylmethyl)-2-oxo-ethyl]-C-morpholino-carbonimidoyl]carbamate CAS Name: N-[[1-[(4-cyano-1-propyl-4-piperidinyl)amino]-3-cycloheptyl-1-oxopropan-2-yl]imino-(4-morpholinyl)methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[N-[1-[(4-cyano-1-propylpiperidin-4-yl)amino]-3-cycloheptyl-1-oxopropan-2-yl]-C-morpholin-4-ylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[(4-cyano-1-propyl-4-piperidyl)amino]-1-(cycloheptylmethyl)-2-keto-ethyl]-C-morpholino-carbonimidoyl]carbamic acid ethyl ester Formula: C27H46N6O4 MolecularWeight: 518.69194

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCCC2)N=C(NC(=O)OCC)N3CCOCC3

Isomeric SMILES

CCCN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCCC2)N=C(NC(=O)OCC)N3CCOCC3

InChI

InChI=1S/C27H46N6O4/c1-3-13-32-14-11-27(21-28,12-15-32)31-24(34)23(20-22-9-7-5-6-8-10-22)29-25(30-26(35)37-4-2)33-16-18-36-19-17-33/h22-23H,3-20H2,1-2H3,(H,31,34)(H,29,30,35)