3-(2,5-dimethylphenyl)-1-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one

Systemtic Name: 3-(2,5-dimethylphenyl)-1-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Openeye Name: 3-(2,5-dimethylphenyl)-1-[4-[1-(2-pyridylmethyl)imidazol-2-yl]-1-piperidyl]prop-2-en-1-one CAS Name: 3-(2,5-dimethylphenyl)-1-[4-[1-(2-pyridinylmethyl)-2-imidazolyl]-1-piperidinyl]-2-propen-1-one IUPAC Name: 3-(2,5-dimethylphenyl)-1-[4-[1-(pyridin-2-ylmethyl)imidazol-2-yl]piperidin-1-yl]prop-2-en-1-one Traditional Name: 3-(2,5-dimethylphenyl)-1-[4-[1-(2-pyridylmethyl)imidazol-2-yl]piperidino]prop-2-en-1-one Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C=CC(=O)N2CCC(CC2)C3=NC=CN3CC4=CC=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C=CC(=O)N2CCC(CC2)C3=NC=CN3CC4=CC=CC=N4

InChI

InChI=1S/C25H28N4O/c1-19-6-7-20(2)22(17-19)8-9-24(30)28-14-10-21(11-15-28)25-27-13-16-29(25)18-23-5-3-4-12-26-23/h3-9,12-13,16-17,21H,10-11,14-15,18H2,1-2H3