8-(3,3-dimethylpiperazin-1-yl)-3-(phenylsulfonyl)quinoline

Systemtic Name: 8-(3,3-dimethylpiperazin-1-yl)-3-(phenylsulfonyl)quinoline Openeye Name: 3-(benzenesulfonyl)-8-(3,3-dimethylpiperazin-1-yl)quinoline CAS Name: 3-(benzenesulfonyl)-8-(3,3-dimethyl-1-piperazinyl)quinoline IUPAC Name: 3-(benzenesulfonyl)-8-(3,3-dimethylpiperazin-1-yl)quinoline Traditional Name: 3-besyl-8-(3,3-dimethylpiperazino)quinoline Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CCN1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CN(CCN1)C2=CC=CC3=CC(=CN=C32)S(=O)(=O)C4=CC=CC=C4)C

InChI

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