2-[[3-cyano-6-oxidanylidene-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[[3-cyano-6-oxidanylidene-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]-N-(6-ethanoyl-1,3-benzodioxol-5-yl)ethanamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]acetamide CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]thio]acetamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[3-cyano-6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]sulfanyl]acetamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[[3-cyano-6-keto-4-(trifluoromethyl)-1H-pyridin-2-yl]thio]acetamide Formula: C18H12F3N3O5S MolecularWeight: 439.36519

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=C(C(=CC(=O)N3)C(F)(F)F)C#N)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1NC(=O)CSC3=C(C(=CC(=O)N3)C(F)(F)F)C#N)OCO2

InChI

InChI=1S/C18H12F3N3O5S/c1-8(25)9-2-13-14(29-7-28-13)4-12(9)23-16(27)6-30-17-10(5-22)11(18(19,20)21)3-15(26)24-17/h2-4H,6-7H2,1H3,(H,23,27)(H,24,26)