8-[[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 8-[[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 8-[[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 8-[[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 8-[[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 8-[(4-mesitylsulfonylpiperazino)methyl]quinoline Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2S/c1-17-14-18(2)23(19(3)15-17)29(27,28)26-12-10-25(11-13-26)16-21-7-4-6-20-8-5-9-24-22(20)21/h4-9,14-15H,10-13,16H2,1-3H3