1-(1,3-benzodioxol-5-yl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 1-(1,3-benzodioxol-5-yl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 1-(1,3-benzodioxol-5-yl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 1-(1,3-benzodioxol-5-yl)-5-(4-methylsulfonylphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-(4-mesylphenyl)-3-(trifluoromethyl)pyrazole Formula: C18H13F3N2O4S MolecularWeight: 410.36703

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=CC4=C(C=C3)OCO4)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2=CC(=NN2C3=CC4=C(C=C3)OCO4)C(F)(F)F

InChI

InChI=1S/C18H13F3N2O4S/c1-28(24,25)13-5-2-11(3-6-13)14-9-17(18(19,20)21)22-23(14)12-4-7-15-16(8-12)27-10-26-15/h2-9H,10H2,1H3