5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-benzaldehyde

Systemtic Name: 5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-benzaldehyde Openeye Name: 5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonyl-benzaldehyde CAS Name: 5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)-1-pyrazolyl]-2-methylsulfonylbenzaldehyde IUPAC Name: 5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-methylsulfonylbenzaldehyde Traditional Name: 2-mesyl-5-[5-(4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzaldehyde Formula: C19H15F3N2O4S MolecularWeight: 424.39361

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)C)C=O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NN2C3=CC(=C(C=C3)S(=O)(=O)C)C=O)C(F)(F)F

InChI

InChI=1S/C19H15F3N2O4S/c1-28-15-6-3-12(4-7-15)16-10-18(19(20,21)22)23-24(16)14-5-8-17(29(2,26)27)13(9-14)11-25/h3-11H,1-2H3