1-(cyclohexylmethyl)-3-[(E)-4-(4-pyridin-2-ylpiperazin-1-yl)but-2-enyl]benzimidazol-2-one

Systemtic Name: 1-(cyclohexylmethyl)-3-[(E)-4-(4-pyridin-2-ylpiperazin-1-yl)but-2-enyl]benzimidazol-2-one Openeye Name: 1-(cyclohexylmethyl)-3-[(E)-4-[4-(2-pyridyl)piperazin-1-yl]but-2-enyl]benzimidazol-2-one CAS Name: 1-(cyclohexylmethyl)-3-[(E)-4-[4-(2-pyridinyl)-1-piperazinyl]but-2-enyl]-2-benzimidazolone IUPAC Name: 1-(cyclohexylmethyl)-3-[(E)-4-(4-pyridin-2-ylpiperazin-1-yl)but-2-enyl]benzimidazol-2-one Traditional Name: 1-(cyclohexylmethyl)-3-[(E)-4-[4-(2-pyridyl)piperazino]but-2-enyl]benzimidazol-2-one Formula: C27H35N5O MolecularWeight: 445.5997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=CC=CC=C3N(C2=O)CC=CCN4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)CN2C3=CC=CC=C3N(C2=O)C/C=C/CN4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H35N5O/c33-27-31(24-12-4-5-13-25(24)32(27)22-23-10-2-1-3-11-23)17-9-8-16-29-18-20-30(21-19-29)26-14-6-7-15-28-26/h4-9,12-15,23H,1-3,10-11,16-22H2/b9-8+