8-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonylquinoline Openeye Name: 8-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonylquinoline CAS Name: 8-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonylquinoline Traditional Name: 8-[4-(2,5-dimethylphenyl)piperazino]sulfonylquinoline Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C21H23N3O2S/c1-16-8-9-17(2)19(15-16)23-11-13-24(14-12-23)27(25,26)20-7-3-5-18-6-4-10-22-21(18)20/h3-10,15H,11-14H2,1-2H3