6-methyl-2-(4-oxidanylidene-4-thiophen-2-yl-butyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile

Systemtic Name: 6-methyl-2-(4-oxidanylidene-4-thiophen-2-yl-butyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Openeye Name: 6-methyl-2-[4-oxo-4-(2-thienyl)butyl]sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile CAS Name: 6-methyl-2-[(4-oxo-4-thiophen-2-ylbutyl)thio]-4-(trifluoromethyl)-3-pyridinecarbonitrile IUPAC Name: 6-methyl-2-(4-oxo-4-thiophen-2-ylbutyl)sulfanyl-4-(trifluoromethyl)pyridine-3-carbonitrile Traditional Name: 2-[[4-keto-4-(2-thienyl)butyl]thio]-6-methyl-4-(trifluoromethyl)nicotinonitrile Formula: C16H13F3N2OS2 MolecularWeight: 370.41243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)C2=CC=CS2

Isomeric SMILES

CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SCCCC(=O)C2=CC=CS2

InChI

InChI=1S/C16H13F3N2OS2/c1-10-8-12(16(17,18)19)11(9-20)15(21-10)24-7-2-4-13(22)14-5-3-6-23-14/h3,5-6,8H,2,4,7H2,1H3