2-(3-methylsulfonylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile

Systemtic Name: 2-(3-methylsulfonylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile Openeye Name: 2-(3-methylsulfonylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile CAS Name: 2-(3-methylsulfonylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile IUPAC Name: 2-(3-methylsulfonylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile Traditional Name: 2-(3-mesylphenyl)-4-(trifluoromethyl)-1H-pyrrole-3-carbonitrile Formula: C13H9F3N2O2S MolecularWeight: 314.28297

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=CN2)C(F)(F)F)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C2=C(C(=CN2)C(F)(F)F)C#N

InChI

InChI=1S/C13H9F3N2O2S/c1-21(19,20)9-4-2-3-8(5-9)12-10(6-17)11(7-18-12)13(14,15)16/h2-5,7,18H,1H3