(6-chloranyl-2-pyridin-4-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-2-pyridin-4-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[6-chloro-2-(4-pyridyl)-4-quinolyl]methanone CAS Name: (6-chloro-2-pyridin-4-yl-4-quinolinyl)-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(6-chloro-2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-[6-chloro-2-(4-pyridyl)-4-quinolyl]methanone Formula: C26H23ClN4O MolecularWeight: 442.94002

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Cl)C5=CC=NC=C5

InChI

InChI=1S/C26H23ClN4O/c27-21-6-7-24-22(16-21)23(17-25(29-24)20-8-10-28-11-9-20)26(32)31-14-12-30(13-15-31)18-19-4-2-1-3-5-19/h1-11,16-17H,12-15,18H2