(7-chloranyl-8-methyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone

Systemtic Name: (7-chloranyl-8-methyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[7-chloro-8-methyl-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [7-chloro-8-methyl-2-(3-pyridinyl)-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(7-chloro-8-methyl-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-[7-chloro-8-methyl-2-(3-pyridyl)-4-quinolyl]methanone Formula: C27H25ClN4O MolecularWeight: 456.9666

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CN=CC=C5)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CN=CC=C5)Cl

InChI

InChI=1S/C27H25ClN4O/c1-19-24(28)10-9-22-23(16-25(30-26(19)22)21-8-5-11-29-17-21)27(33)32-14-12-31(13-15-32)18-20-6-3-2-4-7-20/h2-11,16-17H,12-15,18H2,1H3