[1-[[4-azanyl-4-cyclohexyl-1-(1H-imidazol-5-yl)-9-methyl-6-oxidanyl-3-oxidanylidene-decan-2-yl]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl] N-butyl-N-ethyl-carbamate

Systemtic Name: [1-[[4-azanyl-4-cyclohexyl-1-(1H-imidazol-5-yl)-9-methyl-6-oxidanyl-3-oxidanylidene-decan-2-yl]-methyl-amino]-1-oxidanylidene-3-phenyl-propan-2-yl] N-butyl-N-ethyl-carbamate Openeye Name: [2-[[3-amino-3-cyclohexyl-5-hydroxy-1-(1H-imidazol-5-ylmethyl)-8-methyl-2-oxo-nonyl]-methyl-amino]-1-benzyl-2-oxo-ethyl] N-butyl-N-ethyl-carbamate CAS Name: N-butyl-N-ethylcarbamic acid [1-[[4-amino-4-cyclohexyl-6-hydroxy-1-(1H-imidazol-5-yl)-9-methyl-3-oxodecan-2-yl]-methylamino]-1-oxo-3-phenylpropan-2-yl] ester IUPAC Name: [1-[[4-amino-4-cyclohexyl-6-hydroxy-1-(1H-imidazol-5-yl)-9-methyl-3-oxodecan-2-yl]-methylamino]-1-oxo-3-phenylpropan-2-yl] N-butyl-N-ethylcarbamate Traditional Name: N-butyl-N-ethyl-carbamic acid [2-[[3-amino-3-cyclohexyl-5-hydroxy-1-(1H-imidazol-5-ylmethyl)-2-keto-8-methyl-nonyl]-methyl-amino]-1-benzyl-2-keto-ethyl] ester Formula: C37H59N5O5 MolecularWeight: 653.89486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C(=O)OC(CC1=CC=CC=C1)C(=O)N(C)C(CC2=CN=CN2)C(=O)C(CC(CCC(C)C)O)(C3CCCCC3)N

Isomeric SMILES

CCCCN(CC)C(=O)OC(CC1=CC=CC=C1)C(=O)N(C)C(CC2=CN=CN2)C(=O)C(CC(CCC(C)C)O)(C3CCCCC3)N

InChI

InChI=1S/C37H59N5O5/c1-6-8-21-42(7-2)36(46)47-33(22-28-15-11-9-12-16-28)35(45)41(5)32(23-30-25-39-26-40-30)34(44)37(38,29-17-13-10-14-18-29)24-31(43)20-19-27(3)4/h9,11-12,15-16,25-27,29,31-33,43H,6-8,10,13-14,17-24,38H2,1-5H3,(H,39,40)