(E)-6,6-dimethoxy-3-methylsulfanyl-5-oxidanylidene-2-thiophen-2-yl-hex-3-enenitrile

Systemtic Name: (E)-6,6-dimethoxy-3-methylsulfanyl-5-oxidanylidene-2-thiophen-2-yl-hex-3-enenitrile Openeye Name: (E)-6,6-dimethoxy-3-methylsulfanyl-5-oxo-2-(2-thienyl)hex-3-enenitrile CAS Name: (E)-6,6-dimethoxy-3-(methylthio)-5-oxo-2-thiophen-2-yl-3-hexenenitrile IUPAC Name: (E)-6,6-dimethoxy-3-methylsulfanyl-5-oxo-2-thiophen-2-ylhex-3-enenitrile Traditional Name: (E)-5-keto-6,6-dimethoxy-3-(methylthio)-2-(2-thienyl)hex-3-enenitrile Formula: C13H15NO3S2 MolecularWeight: 297.3931

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)C=C(C(C#N)C1=CC=CS1)SC)OC

Isomeric SMILES

COC(C(=O)/C=C(\C(C#N)C1=CC=CS1)/SC)OC

InChI

InChI=1S/C13H15NO3S2/c1-16-13(17-2)10(15)7-12(18-3)9(8-14)11-5-4-6-19-11/h4-7,9,13H,1-3H3/b12-7+