6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile Openeye Name: 6-(1,3-benzodioxol-5-yl)-2-thioxo-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile CAS Name: 6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2-sulfanylidene-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-thioxo-4-(trifluoromethyl)-1H-pyridine-3-carbonitrile Formula: C14H7F3N2O2S MolecularWeight: 324.27779

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=C(C(=S)N3)C#N)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=C(C(=S)N3)C#N)C(F)(F)F

InChI

InChI=1S/C14H7F3N2O2S/c15-14(16,17)9-4-10(19-13(22)8(9)5-18)7-1-2-11-12(3-7)21-6-20-11/h1-4H,6H2,(H,19,22)