5-[3-(trifluoromethyl)phenyl]sulfanyl-1H-pyrrole-3-carbonitrile

Systemtic Name: 5-[3-(trifluoromethyl)phenyl]sulfanyl-1H-pyrrole-3-carbonitrile Openeye Name: 5-[3-(trifluoromethyl)phenyl]sulfanyl-1H-pyrrole-3-carbonitrile CAS Name: 5-[[3-(trifluoromethyl)phenyl]thio]-1H-pyrrole-3-carbonitrile IUPAC Name: 5-[3-(trifluoromethyl)phenyl]sulfanyl-1H-pyrrole-3-carbonitrile Traditional Name: 5-[[3-(trifluoromethyl)phenyl]thio]-1H-pyrrole-3-carbonitrile Formula: C12H7F3N2S MolecularWeight: 268.25759

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=CC(=CN2)C#N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SC2=CC(=CN2)C#N)C(F)(F)F

InChI

InChI=1S/C12H7F3N2S/c13-12(14,15)9-2-1-3-10(5-9)18-11-4-8(6-16)7-17-11/h1-5,7,17H