3-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,2,3,4-tetrahydroquinoline

Systemtic Name: 3-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,2,3,4-tetrahydroquinoline Openeye Name: 3-methyl-5-[4-(p-tolylsulfonyl)piperazin-1-yl]-1,2,3,4-tetrahydroquinoline CAS Name: 3-methyl-5-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1,2,3,4-tetrahydroquinoline IUPAC Name: 3-methyl-5-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-1,2,3,4-tetrahydroquinoline Traditional Name: 3-methyl-5-(4-tosylpiperazino)-1,2,3,4-tetrahydroquinoline Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)NC1

Isomeric SMILES

CC1CC2=C(C=CC=C2N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C)NC1

InChI

InChI=1S/C21H27N3O2S/c1-16-6-8-18(9-7-16)27(25,26)24-12-10-23(11-13-24)21-5-3-4-20-19(21)14-17(2)15-22-20/h3-9,17,22H,10-15H2,1-2H3