3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-8-methyl-quinoline

Systemtic Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloranyl-8-methyl-quinoline Openeye Name: 3-[5-(4-bromophenyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-3-yl]-2-chloro-8-methyl-quinoline CAS Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloro-8-methylquinoline IUPAC Name: 3-[5-(4-bromophenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]-2-chloro-8-methylquinoline Traditional Name: 3-[5-(4-bromophenyl)-2-tosyl-2-pyrazolin-3-yl]-2-chloro-8-methyl-quinoline Formula: C26H21BrClN3O2S MolecularWeight: 554.88584

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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=C(N=C5C(=CC=CC5=C4)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=C(C=C3)Br)C4=C(N=C5C(=CC=CC5=C4)C)Cl

InChI

InChI=1S/C26H21BrClN3O2S/c1-16-6-12-21(13-7-16)34(32,33)31-24(15-23(30-31)18-8-10-20(27)11-9-18)22-14-19-5-3-4-17(2)25(19)29-26(22)28/h3-14,24H,15H2,1-2H3