2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 2-[[4-(2-methoxy-5-methylphenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 2-[[4-(2-methoxy-5-methylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 2-[[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazino]methyl]quinoline Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H25N3O3S/c1-17-7-10-21(28-2)22(15-17)29(26,27)25-13-11-24(12-14-25)16-19-9-8-18-5-3-4-6-20(18)23-19/h3-10,15H,11-14,16H2,1-2H3