(7-methoxy-2-methyl-quinolin-3-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (7-methoxy-2-methyl-quinolin-3-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (7-methoxy-2-methyl-3-quinolyl)-[4-(p-tolylsulfonyl)piperazin-1-yl]methanone CAS Name: (7-methoxy-2-methyl-3-quinolinyl)-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (7-methoxy-2-methylquinolin-3-yl)-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (7-methoxy-2-methyl-3-quinolyl)-(4-tosylpiperazino)methanone Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N=C4C=C(C=CC4=C3)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(N=C4C=C(C=CC4=C3)OC)C

InChI

InChI=1S/C23H25N3O4S/c1-16-4-8-20(9-5-16)31(28,29)26-12-10-25(11-13-26)23(27)21-14-18-6-7-19(30-3)15-22(18)24-17(21)2/h4-9,14-15H,10-13H2,1-3H3