[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-(methylcarbamoyl)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-(methylcarbamoyl)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] 4-(methylcarbamoyl)piperazine-1-carboxylate CAS Name: 4-(methylcarbamoyl)-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-(methylcarbamoyl)piperazine-1-carboxylate Traditional Name: 4-(methylcarbamoyl)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: C37H57N7O6 MolecularWeight: 695.89178

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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(CC4)C(=O)NC)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(CC4)C(=O)NC)N)O

InChI

InChI=1S/C37H57N7O6/c1-26(2)15-16-30(45)23-37(38,28-13-9-6-10-14-28)33(46)31(22-29-24-40-25-41-29)42(4)34(47)32(21-27-11-7-5-8-12-27)50-36(49)44-19-17-43(18-20-44)35(48)39-3/h5,7-8,11-12,24-26,28,30-32,45H,6,9-10,13-23,38H2,1-4H3,(H,39,48)(H,40,41)