[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-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-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-[2-(dimethylamino)-2-oxidanylidene-ethyl]-N-methyl-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-[2-(dimethylamino)-2-oxo-ethyl]-N-methyl-carbamate CAS Name: N-[2-(dimethylamino)-2-oxoethyl]-N-methylcarbamic 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-[2-(dimethylamino)-2-oxoethyl]-N-methylcarbamate Traditional Name: N-[2-(dimethylamino)-2-keto-ethyl]-N-methyl-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: C36H56N6O6 MolecularWeight: 668.86644

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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)N(C)CC(=O)N(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)N(C)CC(=O)N(C)C)N)O

InChI

InChI=1S/C36H56N6O6/c1-25(2)17-18-29(43)21-36(37,27-15-11-8-12-16-27)33(45)30(20-28-22-38-24-39-28)42(6)34(46)31(19-26-13-9-7-10-14-26)48-35(47)41(5)23-32(44)40(3)4/h7,9-10,13-14,22,24-25,27,29-31,43H,8,11-12,15-21,23,37H2,1-6H3,(H,38,39)