(3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-2-methylsulfonyl-1,3-dihydropyrazole

Systemtic Name: (3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-2-methylsulfonyl-1,3-dihydropyrazole Openeye Name: (3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-2-methylsulfonyl-1,3-dihydropyrazole CAS Name: (3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-2-methylsulfonyl-1,3-dihydropyrazole IUPAC Name: (3S)-5-(3,4-dimethoxyphenyl)-3-(4-ethylphenyl)-2-methylsulfonyl-1,3-dihydropyrazole Traditional Name: (5S)-3-(3,4-dimethoxyphenyl)-5-(4-ethylphenyl)-1-mesyl-3-pyrazoline Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C=C(NN2S(=O)(=O)C)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H]2C=C(NN2S(=O)(=O)C)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N2O4S/c1-5-14-6-8-15(9-7-14)18-13-17(21-22(18)27(4,23)24)16-10-11-19(25-2)20(12-16)26-3/h6-13,18,21H,5H2,1-4H3/t18-/m0/s1