2-chloranyl-6-methoxy-3-[5-(4-methylphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline

Systemtic Name: 2-chloranyl-6-methoxy-3-[5-(4-methylphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline Openeye Name: 2-chloro-6-methoxy-3-[2-methylsulfonyl-5-(p-tolyl)-3,4-dihydropyrazol-3-yl]quinoline CAS Name: 2-chloro-6-methoxy-3-[5-(4-methylphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline IUPAC Name: 2-chloro-6-methoxy-3-[5-(4-methylphenyl)-2-methylsulfonyl-3,4-dihydropyrazol-3-yl]quinoline Traditional Name: 2-chloro-3-[2-mesyl-5-(p-tolyl)-2-pyrazolin-3-yl]-6-methoxy-quinoline Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O3S/c1-13-4-6-14(7-5-13)19-12-20(25(24-19)29(3,26)27)17-11-15-10-16(28-2)8-9-18(15)23-21(17)22/h4-11,20H,12H2,1-3H3