(E)-1-(1-ethyl-2-methyl-benzimidazol-5-yl)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-en-1-one

Systemtic Name: (E)-1-(1-ethyl-2-methyl-benzimidazol-5-yl)-3-[1-(phenylmethyl)piperidin-4-yl]prop-2-en-1-one Openeye Name: (E)-3-(1-benzyl-4-piperidyl)-1-(1-ethyl-2-methyl-benzimidazol-5-yl)prop-2-en-1-one CAS Name: (E)-1-(1-ethyl-2-methyl-5-benzimidazolyl)-3-[1-(phenylmethyl)-4-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(1-benzylpiperidin-4-yl)-1-(1-ethyl-2-methylbenzimidazol-5-yl)prop-2-en-1-one Traditional Name: (E)-3-(1-benzyl-4-piperidyl)-1-(1-ethyl-2-methyl-benzimidazol-5-yl)prop-2-en-1-one Formula: C25H29N3O MolecularWeight: 387.51726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)C=CC3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)/C=C/C3CCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H29N3O/c1-3-28-19(2)26-23-17-22(10-11-24(23)28)25(29)12-9-20-13-15-27(16-14-20)18-21-7-5-4-6-8-21/h4-12,17,20H,3,13-16,18H2,1-2H3/b12-9+