2-chloranyl-3-[(3S)-5-(4-methoxyphenyl)-2-(phenylsulfonyl)-1,3-dihydropyrazol-3-yl]-7-methyl-quinoline

Systemtic Name: 2-chloranyl-3-[(3S)-5-(4-methoxyphenyl)-2-(phenylsulfonyl)-1,3-dihydropyrazol-3-yl]-7-methyl-quinoline Openeye Name: 3-[(3S)-2-(benzenesulfonyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-3-yl]-2-chloro-7-methyl-quinoline CAS Name: 3-[(3S)-2-(benzenesulfonyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-3-yl]-2-chloro-7-methylquinoline IUPAC Name: 3-[(3S)-2-(benzenesulfonyl)-5-(4-methoxyphenyl)-1,3-dihydropyrazol-3-yl]-2-chloro-7-methylquinoline Traditional Name: 3-[(3S)-2-besyl-5-(4-methoxyphenyl)-3-pyrazolin-3-yl]-2-chloro-7-methyl-quinoline Formula: C26H22ClN3O3S MolecularWeight: 491.98918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C3C=C(NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)[C@@H]3C=C(NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC)Cl

InChI

InChI=1S/C26H22ClN3O3S/c1-17-8-9-19-15-22(26(27)28-23(19)14-17)25-16-24(18-10-12-20(33-2)13-11-18)29-30(25)34(31,32)21-6-4-3-5-7-21/h3-16,25,29H,1-2H3/t25-/m0/s1