5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile

Systemtic Name: 5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile Openeye Name: 5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile CAS Name: 5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)-4-pyrazolecarbonitrile IUPAC Name: 5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile Traditional Name: 5-(4-methoxyphenyl)sulfonyl-1-methyl-3-(trifluoromethyl)pyrazole-4-carbonitrile Formula: C13H10F3N3O3S MolecularWeight: 345.29701

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)C#N)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)C#N)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H10F3N3O3S/c1-19-12(10(7-17)11(18-19)13(14,15)16)23(20,21)9-5-3-8(22-2)4-6-9/h3-6H,1-2H3