(4-methylphenyl)-[1-[[5-(4-methylpiperazin-1-yl)carbonylquinolin-3-yl]methyl]pyrrol-2-yl]methanone

Systemtic Name: (4-methylphenyl)-[1-[[5-(4-methylpiperazin-1-yl)carbonylquinolin-3-yl]methyl]pyrrol-2-yl]methanone Openeye Name: [1-[[5-(4-methylpiperazine-1-carbonyl)-3-quinolyl]methyl]pyrrol-2-yl]-(p-tolyl)methanone CAS Name: (4-methylphenyl)-[1-[[5-[(4-methyl-1-piperazinyl)-oxomethyl]-3-quinolinyl]methyl]-2-pyrrolyl]methanone IUPAC Name: (4-methylphenyl)-[1-[[5-(4-methylpiperazine-1-carbonyl)quinolin-3-yl]methyl]pyrrol-2-yl]methanone Traditional Name: [1-[[5-(4-methylpiperazine-1-carbonyl)-3-quinolyl]methyl]pyrrol-2-yl]-(p-tolyl)methanone Formula: C28H28N4O2 MolecularWeight: 452.54752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CN2CC3=CC4=C(C=CC=C4N=C3)C(=O)N5CCN(CC5)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CN2CC3=CC4=C(C=CC=C4N=C3)C(=O)N5CCN(CC5)C

InChI

InChI=1S/C28H28N4O2/c1-20-8-10-22(11-9-20)27(33)26-7-4-12-32(26)19-21-17-24-23(5-3-6-25(24)29-18-21)28(34)31-15-13-30(2)14-16-31/h3-12,17-18H,13-16,19H2,1-2H3