3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-quinoline

Systemtic Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-quinoline Openeye Name: 3-[5-(4-bromophenyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-3-yl]-2-chloro-quinoline CAS Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloroquinoline IUPAC Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloroquinoline Traditional Name: 3-[5-(4-bromophenyl)-2-tosyl-2-pyrazolin-3-yl]-2-chloro-quinoline Formula: C25H19BrClN3O2S MolecularWeight: 540.85926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)C4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)C4=CC5=CC=CC=C5N=C4Cl

InChI

InChI=1S/C25H19BrClN3O2S/c1-16-6-12-20(13-7-16)33(31,32)30-24(15-23(29-30)17-8-10-19(26)11-9-17)21-14-18-4-2-3-5-22(18)28-25(21)27/h2-14,24H,15H2,1H3