[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone

Systemtic Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Openeye Name: [4-(p-tolylsulfonyl)piperazin-1-yl]-[2-(4-pyridyl)-4-quinolyl]methanone CAS Name: [4-(4-methylphenyl)sulfonyl-1-piperazinyl]-(2-pyridin-4-yl-4-quinolinyl)methanone IUPAC Name: [4-(4-methylphenyl)sulfonylpiperazin-1-yl]-(2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: [2-(4-pyridyl)-4-quinolyl]-(4-tosylpiperazino)methanone Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=NC=C5

InChI

InChI=1S/C26H24N4O3S/c1-19-6-8-21(9-7-19)34(32,33)30-16-14-29(15-17-30)26(31)23-18-25(20-10-12-27-13-11-20)28-24-5-3-2-4-22(23)24/h2-13,18H,14-17H2,1H3