6-(3,5-dimethylphenyl)sulfonyl-4-piperazin-1-yl-quinoline

Systemtic Name: 6-(3,5-dimethylphenyl)sulfonyl-4-piperazin-1-yl-quinoline Openeye Name: 6-(3,5-dimethylphenyl)sulfonyl-4-piperazin-1-yl-quinoline CAS Name: 6-(3,5-dimethylphenyl)sulfonyl-4-(1-piperazinyl)quinoline IUPAC Name: 6-(3,5-dimethylphenyl)sulfonyl-4-piperazin-1-ylquinoline Traditional Name: 6-(3,5-dimethylphenyl)sulfonyl-4-piperazino-quinoline Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)S(=O)(=O)C2=CC3=C(C=CN=C3C=C2)N4CCNCC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)S(=O)(=O)C2=CC3=C(C=CN=C3C=C2)N4CCNCC4)C

InChI

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