8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 8-[[4-(p-tolylsulfonyl)piperazin-1-yl]methyl]quinoline CAS Name: 8-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 8-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 8-[(4-tosylpiperazino)methyl]quinoline Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H23N3O2S/c1-17-7-9-20(10-8-17)27(25,26)24-14-12-23(13-15-24)16-19-5-2-4-18-6-3-11-22-21(18)19/h2-11H,12-16H2,1H3