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

Systemtic Name: 2-chloranyl-3-[5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline Openeye Name: 2-chloro-3-[5-(4-methoxyphenyl)-2-(p-tolylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoline CAS Name: 2-chloro-3-[5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline IUPAC Name: 2-chloro-3-[5-(4-methoxyphenyl)-2-(4-methylphenyl)sulfonyl-3,4-dihydropyrazol-3-yl]quinoline Traditional Name: 2-chloro-3-[5-(4-methoxyphenyl)-2-tosyl-2-pyrazolin-3-yl]quinoline Formula: C26H22ClN3O3S MolecularWeight: 491.98918

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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)OC)C4=CC5=CC=CC=C5N=C4Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H22ClN3O3S/c1-17-7-13-21(14-8-17)34(31,32)30-25(16-24(29-30)18-9-11-20(33-2)12-10-18)22-15-19-5-3-4-6-23(19)28-26(22)27/h3-15,25H,16H2,1-2H3