(6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[6-chloro-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [6-chloro-2-(3-pyridinyl)-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(6-chloro-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-[6-chloro-2-(3-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=CN=CC=C5

Isomeric SMILES

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

InChI

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