2-methylpropyl N-[N-[1-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-3-(6,6-dimethyl-3-bicyclo[3.1.1]heptanyl)-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate

Systemtic Name: 2-methylpropyl N-[N-[1-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-3-(6,6-dimethyl-3-bicyclo[3.1.1]heptanyl)-1-oxidanylidene-propan-2-yl]-C-morpholin-4-yl-carbonimidoyl]carbamate Openeye Name: isobutyl N-[N-[2-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-1-[(6,6-dimethylnorpinan-3-yl)methyl]-2-oxo-ethyl]-C-morpholino-carbonimidoyl]carbamate CAS Name: N-[[1-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-3-(6,6-dimethyl-3-bicyclo[3.1.1]heptanyl)-1-oxopropan-2-yl]imino-(4-morpholinyl)methyl]carbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[N-[1-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-3-(6,6-dimethyl-3-bicyclo[3.1.1]heptanyl)-1-oxopropan-2-yl]-C-morpholin-4-ylcarbonimidoyl]carbamate Traditional Name: N-[N-[2-[[1-cyano-3-(cyclopentylmethyl)cyclopentyl]amino]-1-[(6,6-dimethylnorpinan-3-yl)methyl]-2-keto-ethyl]-C-morpholino-carbonimidoyl]carbamic acid isobutyl ester Formula: C34H55N5O4 MolecularWeight: 597.8316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)NC(=NC(CC1CC2CC(C1)C2(C)C)C(=O)NC3(CCC(C3)CC4CCCC4)C#N)N5CCOCC5

Isomeric SMILES

CC(C)COC(=O)NC(=NC(CC1CC2CC(C1)C2(C)C)C(=O)NC3(CCC(C3)CC4CCCC4)C#N)N5CCOCC5

InChI

InChI=1S/C34H55N5O4/c1-23(2)21-43-32(41)37-31(39-11-13-42-14-12-39)36-29(18-26-16-27-19-28(17-26)33(27,3)4)30(40)38-34(22-35)10-9-25(20-34)15-24-7-5-6-8-24/h23-29H,5-21H2,1-4H3,(H,38,40)(H,36,37,41)