2-methyl-7-(phenylsulfonyl)-4-piperazin-1-yl-quinoline hydrochloride

Systemtic Name: 2-methyl-7-(phenylsulfonyl)-4-piperazin-1-yl-quinoline hydrochloride Openeye Name: 7-(benzenesulfonyl)-2-methyl-4-piperazin-1-yl-quinoline hydrochloride CAS Name: 7-(benzenesulfonyl)-2-methyl-4-(1-piperazinyl)quinoline hydrochloride IUPAC Name: 7-(benzenesulfonyl)-2-methyl-4-piperazin-1-ylquinoline hydrochloride Traditional Name: 7-besyl-2-methyl-4-piperazino-quinoline hydrochloride Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)C(=C1)N4CCNCC4.Cl

Isomeric SMILES

CC1=NC2=C(C=CC(=C2)S(=O)(=O)C3=CC=CC=C3)C(=C1)N4CCNCC4.Cl

InChI

InChI=1S/C20H21N3O2S.ClH/c1-15-13-20(23-11-9-21-10-12-23)18-8-7-17(14-19(18)22-15)26(24,25)16-5-3-2-4-6-16;/h2-8,13-14,21H,9-12H2,1H3;1H