(5-methyl-2-propan-2-yl-cyclohexyl) 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-cyclohexyl) 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylate Openeye Name: (2-isopropyl-5-methyl-cyclohexyl) 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylate CAS Name: 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]-1-piperazinecarboxylic acid (5-methyl-2-propan-2-ylcyclohexyl) ester IUPAC Name: (5-methyl-2-propan-2-ylcyclohexyl) 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylate Traditional Name: 4-[2-(4-cyanophenyl)-1-(1H-imidazol-5-yl)ethyl]piperazine-1-carboxylic acid (2-isopropyl-5-methyl-cyclohexyl) ester Formula: C27H37N5O2 MolecularWeight: 463.61498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=O)N2CCN(CC2)C(CC3=CC=C(C=C3)C#N)C4=CN=CN4)C(C)C

Isomeric SMILES

CC1CCC(C(C1)OC(=O)N2CCN(CC2)C(CC3=CC=C(C=C3)C#N)C4=CN=CN4)C(C)C

InChI

InChI=1S/C27H37N5O2/c1-19(2)23-9-4-20(3)14-26(23)34-27(33)32-12-10-31(11-13-32)25(24-17-29-18-30-24)15-21-5-7-22(16-28)8-6-21/h5-8,17-20,23,25-26H,4,9-15H2,1-3H3,(H,29,30)