4-[2-[4-(2-cyclohexyl-2-phenyl-ethanoyl)piperazin-1-yl]-2-(1H-imidazol-5-yl)ethyl]benzenecarbonitrile

Systemtic Name: 4-[2-[4-(2-cyclohexyl-2-phenyl-ethanoyl)piperazin-1-yl]-2-(1H-imidazol-5-yl)ethyl]benzenecarbonitrile Openeye Name: 4-[2-[4-(2-cyclohexyl-2-phenyl-acetyl)piperazin-1-yl]-2-(1H-imidazol-5-yl)ethyl]benzonitrile CAS Name: 4-[2-[4-(2-cyclohexyl-1-oxo-2-phenylethyl)-1-piperazinyl]-2-(1H-imidazol-5-yl)ethyl]benzonitrile IUPAC Name: 4-[2-[4-(2-cyclohexyl-2-phenylacetyl)piperazin-1-yl]-2-(1H-imidazol-5-yl)ethyl]benzonitrile Traditional Name: 4-[2-[4-(2-cyclohexyl-2-phenyl-acetyl)piperazino]-2-(1H-imidazol-5-yl)ethyl]benzonitrile Formula: C30H35N5O MolecularWeight: 481.6318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=CC=C2)C(=O)N3CCN(CC3)C(CC4=CC=C(C=C4)C#N)C5=CN=CN5

Isomeric SMILES

C1CCC(CC1)C(C2=CC=CC=C2)C(=O)N3CCN(CC3)C(CC4=CC=C(C=C4)C#N)C5=CN=CN5

InChI

InChI=1S/C30H35N5O/c31-20-24-13-11-23(12-14-24)19-28(27-21-32-22-33-27)34-15-17-35(18-16-34)30(36)29(25-7-3-1-4-8-25)26-9-5-2-6-10-26/h1,3-4,7-8,11-14,21-22,26,28-29H,2,5-6,9-10,15-19H2,(H,32,33)