6-chloranyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-methylphenyl)sulfonyl-quinoline

Systemtic Name: 6-chloranyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-methylphenyl)sulfonyl-quinoline Openeye Name: 6-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(p-tolylsulfonyl)quinoline CAS Name: 6-chloro-4-[4-(2-methoxyphenyl)-1-piperazinyl]-3-(4-methylphenyl)sulfonylquinoline IUPAC Name: 6-chloro-4-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(4-methylphenyl)sulfonylquinoline Traditional Name: 6-chloro-4-[4-(2-methoxyphenyl)piperazino]-3-tosyl-quinoline Formula: C27H26ClN3O3S MolecularWeight: 508.03164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)C5=CC=CC=C5OC)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN=C3C=CC(=CC3=C2N4CCN(CC4)C5=CC=CC=C5OC)Cl

InChI

InChI=1S/C27H26ClN3O3S/c1-19-7-10-21(11-8-19)35(32,33)26-18-29-23-12-9-20(28)17-22(23)27(26)31-15-13-30(14-16-31)24-5-3-4-6-25(24)34-2/h3-12,17-18H,13-16H2,1-2H3