3-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole

Systemtic Name: 3-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole Openeye Name: 3-(2,3-dimethoxyphenyl)-2-(p-tolylsulfonyl)-5-(2-thienyl)-3,4-dihydropyrazole CAS Name: 3-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole IUPAC Name: 3-(2,3-dimethoxyphenyl)-2-(4-methylphenyl)sulfonyl-5-thiophen-2-yl-3,4-dihydropyrazole Traditional Name: 5-(2,3-dimethoxyphenyl)-3-(2-thienyl)-1-tosyl-2-pyrazoline Formula: C22H22N2O4S2 MolecularWeight: 442.55108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=CS3)C4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(=N2)C3=CC=CS3)C4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C22H22N2O4S2/c1-15-9-11-16(12-10-15)30(25,26)24-19(14-18(23-24)21-8-5-13-29-21)17-6-4-7-20(27-2)22(17)28-3/h4-13,19H,14H2,1-3H3