2-[5-cyano-2-[[(1-pyridin-4-ylpiperidin-4-yl)amino]methyl]benzimidazol-1-yl]-N-cyclohexyl-ethanamide

Systemtic Name: 2-[5-cyano-2-[[(1-pyridin-4-ylpiperidin-4-yl)amino]methyl]benzimidazol-1-yl]-N-cyclohexyl-ethanamide Openeye Name: 2-[5-cyano-2-[[[1-(4-pyridyl)-4-piperidyl]amino]methyl]benzimidazol-1-yl]-N-cyclohexyl-acetamide CAS Name: 2-[5-cyano-2-[[(1-pyridin-4-yl-4-piperidinyl)amino]methyl]-1-benzimidazolyl]-N-cyclohexylacetamide IUPAC Name: 2-[5-cyano-2-[[(1-pyridin-4-ylpiperidin-4-yl)amino]methyl]benzimidazol-1-yl]-N-cyclohexylacetamide Traditional Name: 2-[5-cyano-2-[[[1-(4-pyridyl)-4-piperidyl]amino]methyl]benzimidazol-1-yl]-N-cyclohexyl-acetamide Formula: C27H33N7O MolecularWeight: 471.59722

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN2C3=C(C=C(C=C3)C#N)N=C2CNC4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)CN2C3=C(C=C(C=C3)C#N)N=C2CNC4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C27H33N7O/c28-17-20-6-7-25-24(16-20)32-26(34(25)19-27(35)31-22-4-2-1-3-5-22)18-30-21-10-14-33(15-11-21)23-8-12-29-13-9-23/h6-9,12-13,16,21-22,30H,1-5,10-11,14-15,18-19H2,(H,31,35)