3-(2-methylphenyl)sulfonyl-8-(3-methylpiperazin-1-yl)quinoline

Systemtic Name: 3-(2-methylphenyl)sulfonyl-8-(3-methylpiperazin-1-yl)quinoline Openeye Name: 8-(3-methylpiperazin-1-yl)-3-(o-tolylsulfonyl)quinoline CAS Name: 3-(2-methylphenyl)sulfonyl-8-(3-methyl-1-piperazinyl)quinoline IUPAC Name: 3-(2-methylphenyl)sulfonyl-8-(3-methylpiperazin-1-yl)quinoline Traditional Name: 8-(3-methylpiperazino)-3-(o-tolylsulfonyl)quinoline Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4C

Isomeric SMILES

CC1CN(CCN1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4C

InChI

InChI=1S/C21H23N3O2S/c1-15-6-3-4-9-20(15)27(25,26)18-12-17-7-5-8-19(21(17)23-13-18)24-11-10-22-16(2)14-24/h3-9,12-13,16,22H,10-11,14H2,1-2H3