2-chloranyl-7-methyl-3-[5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline

Systemtic Name: 2-chloranyl-7-methyl-3-[5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline Openeye Name: 2-chloro-7-methyl-3-[5-(p-tolyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoline CAS Name: 2-chloro-7-methyl-3-[5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline IUPAC Name: 2-chloro-7-methyl-3-[5-(4-methylphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline Traditional Name: 2-chloro-7-methyl-3-[5-(p-tolyl)-2-tosyl-2-pyrazolin-3-yl]quinoline Formula: C27H24ClN3O2S MolecularWeight: 490.01636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C(C=CC4=C3)C)Cl)S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C(C=CC4=C3)C)Cl)S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C27H24ClN3O2S/c1-17-4-9-20(10-5-17)25-16-26(23-15-21-11-6-19(3)14-24(21)29-27(23)28)31(30-25)34(32,33)22-12-7-18(2)8-13-22/h4-15,26H,16H2,1-3H3