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

Systemtic Name: 3-methoxybutyl N-[N-[1-[(4-cyano-1-methyl-piperidin-4-yl)amino]-3-cyclohexyl-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate Openeye Name: 3-methoxybutyl N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-C-morpholino-carbonimidoyl]carbamate CAS Name: N-[[1-[(4-cyano-1-methyl-4-piperidinyl)amino]-3-cyclohexyl-1-oxopropan-2-yl]imino-(4-morpholinyl)methyl]carbamic acid 3-methoxybutyl ester IUPAC Name: 3-methoxybutyl N-[N-[1-[(4-cyano-1-methylpiperidin-4-yl)amino]-3-cyclohexyl-1-oxopropan-2-yl]-C-morpholin-4-ylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[(4-cyano-1-methyl-4-piperidyl)amino]-1-(cyclohexylmethyl)-2-keto-ethyl]-C-morpholino-carbonimidoyl]carbamic acid 3-methoxybutyl ester Formula: C27H46N6O5 MolecularWeight: 534.69134

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C)C#N)N3CCOCC3)OC

Isomeric SMILES

CC(CCOC(=O)NC(=NC(CC1CCCCC1)C(=O)NC2(CCN(CC2)C)C#N)N3CCOCC3)OC

InChI

InChI=1S/C27H46N6O5/c1-21(36-3)9-16-38-26(35)30-25(33-14-17-37-18-15-33)29-23(19-22-7-5-4-6-8-22)24(34)31-27(20-28)10-12-32(2)13-11-27/h21-23H,4-19H2,1-3H3,(H,31,34)(H,29,30,35)