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

Systemtic Name: [N-[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamic acid Openeye Name: [N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-C-morpholino-carbonimidoyl]carbamic acid CAS Name: [[1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]imino-(4-morpholinyl)methyl]carbamic acid IUPAC Name: [N-[1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-C-morpholin-4-ylcarbonimidoyl]carbamic acid Traditional Name: [N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]-C-morpholino-carbonimidoyl]carbamic acid Formula: C22H36N6O4 MolecularWeight: 448.55904

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC(=O)O)N3CCOCC3

Isomeric SMILES

CN1CCC(CC1)(C#N)NC(=O)C(CC2CCCCC2)N=C(NC(=O)O)N3CCOCC3

InChI

InChI=1S/C22H36N6O4/c1-27-9-7-22(16-23,8-10-27)26-19(29)18(15-17-5-3-2-4-6-17)24-20(25-21(30)31)28-11-13-32-14-12-28/h17-18H,2-15H2,1H3,(H,24,25)(H,26,29)(H,30,31)