[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] 4-methyl-2-(2-methylpropyl)-3-oxidanylidene-piperazine-1-carboxylate

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] 4-methyl-2-(2-methylpropyl)-3-oxidanylidene-piperazine-1-carboxylate 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] 2-isobutyl-4-methyl-3-oxo-piperazine-1-carboxylate CAS Name: 4-methyl-2-(2-methylpropyl)-3-oxo-1-piperazinecarboxylic 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] 4-methyl-2-(2-methylpropyl)-3-oxopiperazine-1-carboxylate Traditional Name: 2-isobutyl-3-keto-4-methyl-piperazine-1-carboxylic 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: C40H62N6O6 MolecularWeight: 722.95688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(CC(C1CCCCC1)(C(=O)C(CC2=CN=CN2)N(C)C(=O)C(CC3=CC=CC=C3)OC(=O)N4CCN(C(=O)C4CC(C)C)C)N)O

Isomeric SMILES

CC(C)CCC(CC(C1CCCCC1)(C(=O)C(CC2=CN=CN2)N(C)C(=O)C(CC3=CC=CC=C3)OC(=O)N4CCN(C(=O)C4CC(C)C)C)N)O

InChI

InChI=1S/C40H62N6O6/c1-27(2)17-18-32(47)24-40(41,30-15-11-8-12-16-30)36(48)33(23-31-25-42-26-43-31)45(6)38(50)35(22-29-13-9-7-10-14-29)52-39(51)46-20-19-44(5)37(49)34(46)21-28(3)4/h7,9-10,13-14,25-28,30,32-35,47H,8,11-12,15-24,41H2,1-6H3,(H,42,43)