[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-butanoyl-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-butanoyl-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-butanoylhexahydropyridazine-1-carboxylate CAS Name: 2-(1-oxobutyl)-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-butanoyldiazinane-1-carboxylate Traditional Name: 2-butyrylhexahydropyridazine-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: C39H60N6O6 MolecularWeight: 708.9303

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCCCN1C(=O)OC(CC2=CC=CC=C2)C(=O)N(C)C(CC3=CN=CN3)C(=O)C(CC(CCC(C)C)O)(C4CCCCC4)N

Isomeric SMILES

CCCC(=O)N1CCCCN1C(=O)OC(CC2=CC=CC=C2)C(=O)N(C)C(CC3=CN=CN3)C(=O)C(CC(CCC(C)C)O)(C4CCCCC4)N

InChI

InChI=1S/C39H60N6O6/c1-5-14-35(47)44-21-12-13-22-45(44)38(50)51-34(23-29-15-8-6-9-16-29)37(49)43(4)33(24-31-26-41-27-42-31)36(48)39(40,30-17-10-7-11-18-30)25-32(46)20-19-28(2)3/h6,8-9,15-16,26-28,30,32-34,46H,5,7,10-14,17-25,40H2,1-4H3,(H,41,42)