3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole

Systemtic Name: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole Openeye Name: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole CAS Name: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole IUPAC Name: 3-(4-chlorophenyl)-5-(3,4-dimethoxyphenyl)-2-methylsulfonyl-3,4-dihydropyrazole Traditional Name: 5-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-mesyl-2-pyrazoline Formula: C18H19ClN2O4S MolecularWeight: 394.87246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)Cl)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(C2)C3=CC=C(C=C3)Cl)S(=O)(=O)C)OC

InChI

InChI=1S/C18H19ClN2O4S/c1-24-17-9-6-13(10-18(17)25-2)15-11-16(21(20-15)26(3,22)23)12-4-7-14(19)8-5-12/h4-10,16H,11H2,1-3H3