[2-(3,4-dimethoxyphenyl)quinolin-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [2-(3,4-dimethoxyphenyl)quinolin-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: [2-(3,4-dimethoxyphenyl)-4-quinolyl]-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: [2-(3,4-dimethoxyphenyl)-4-quinolinyl]-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: [2-(3,4-dimethoxyphenyl)quinolin-4-yl]-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: [2-(3,4-dimethoxyphenyl)-4-quinolyl]-(4-tosylpiperazino)methanone Formula: C29H29N3O5S MolecularWeight: 531.62266

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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(=C(C=C5)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H29N3O5S/c1-20-8-11-22(12-9-20)38(34,35)32-16-14-31(15-17-32)29(33)24-19-26(30-25-7-5-4-6-23(24)25)21-10-13-27(36-2)28(18-21)37-3/h4-13,18-19H,14-17H2,1-3H3