4-[[5-[[4-(3-cyclohexyl-2-oxidanyl-propanoyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[5-[[4-(3-cyclohexyl-2-oxidanyl-propanoyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[5-[[4-(3-cyclohexyl-2-hydroxy-propanoyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile CAS Name: 4-[[5-[[4-(3-cyclohexyl-2-hydroxy-1-oxopropyl)-1-piperazinyl]methyl]-1-imidazolyl]methyl]benzonitrile IUPAC Name: 4-[[5-[[4-(3-cyclohexyl-2-hydroxypropanoyl)piperazin-1-yl]methyl]imidazol-1-yl]methyl]benzonitrile Traditional Name: 4-[[5-[[4-(3-cyclohexyl-2-hydroxy-propanoyl)piperazino]methyl]imidazol-1-yl]methyl]benzonitrile Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)O

Isomeric SMILES

C1CCC(CC1)CC(C(=O)N2CCN(CC2)CC3=CN=CN3CC4=CC=C(C=C4)C#N)O

InChI

InChI=1S/C25H33N5O2/c26-15-21-6-8-22(9-7-21)17-30-19-27-16-23(30)18-28-10-12-29(13-11-28)25(32)24(31)14-20-4-2-1-3-5-20/h6-9,16,19-20,24,31H,1-5,10-14,17-18H2