(6-methyl-2-pyridin-4-yl-quinolin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone

Systemtic Name: (6-methyl-2-pyridin-4-yl-quinolin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Openeye Name: [4-[(E)-cinnamyl]piperazin-1-yl]-[6-methyl-2-(4-pyridyl)-4-quinolyl]methanone CAS Name: (6-methyl-2-pyridin-4-yl-4-quinolinyl)-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methanone IUPAC Name: (6-methyl-2-pyridin-4-ylquinolin-4-yl)-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]methanone Traditional Name: [4-[(E)-cinnamyl]piperazino]-[6-methyl-2-(4-pyridyl)-4-quinolyl]methanone Formula: C29H28N4O MolecularWeight: 448.55882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)CC=CC4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C29H28N4O/c1-22-9-10-27-25(20-22)26(21-28(31-27)24-11-13-30-14-12-24)29(34)33-18-16-32(17-19-33)15-5-8-23-6-3-2-4-7-23/h2-14,20-21H,15-19H2,1H3/b8-5+