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

Systemtic Name: 2-chloranyl-7-ethoxy-3-[5-(4-methoxyphenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazol-3-yl]quinoline Openeye Name: 3-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-2-chloro-7-ethoxy-quinoline CAS Name: 3-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-2-chloro-7-ethoxyquinoline IUPAC Name: 3-[2-(benzenesulfonyl)-5-(4-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-2-chloro-7-ethoxyquinoline Traditional Name: 3-[2-besyl-5-(4-methoxyphenyl)-2-pyrazolin-3-yl]-2-chloro-7-ethoxy-quinoline Formula: C27H24ClN3O4S MolecularWeight: 522.01516

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=NC(=C(C=C2C=C1)C3CC(=NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC)Cl

Isomeric SMILES

CCOC1=CC2=NC(=C(C=C2C=C1)C3CC(=NN3S(=O)(=O)C4=CC=CC=C4)C5=CC=C(C=C5)OC)Cl

InChI

InChI=1S/C27H24ClN3O4S/c1-3-35-21-14-11-19-15-23(27(28)29-24(19)16-21)26-17-25(18-9-12-20(34-2)13-10-18)30-31(26)36(32,33)22-7-5-4-6-8-22/h4-16,26H,3,17H2,1-2H3