[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] 2-(phenylcarbonyl)-1,2-diazinane-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] 2-(phenylcarbonyl)-1,2-diazinane-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-benzoylhexahydropyridazine-1-carboxylate CAS Name: 2-benzoyl-1-diazinanecarboxylic 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] 2-benzoyldiazinane-1-carboxylate Traditional Name: 2-benzoylhexahydropyridazine-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: C42H58N6O6 MolecularWeight: 742.94652

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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)N4CCCCN4C(=O)C5=CC=CC=C5)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)N4CCCCN4C(=O)C5=CC=CC=C5)N)O

InChI

InChI=1S/C42H58N6O6/c1-30(2)21-22-35(49)27-42(43,33-19-11-6-12-20-33)38(50)36(26-34-28-44-29-45-34)46(3)40(52)37(25-31-15-7-4-8-16-31)54-41(53)48-24-14-13-23-47(48)39(51)32-17-9-5-10-18-32/h4-5,7-10,15-18,28-30,33,35-37,49H,6,11-14,19-27,43H2,1-3H3,(H,44,45)