methyl (2E)-2-cyano-2-[2-(2,2-dicyano-1-methylsulfanyl-ethenyl)cyclopentylidene]ethanoate

Systemtic Name: methyl (2E)-2-cyano-2-[2-(2,2-dicyano-1-methylsulfanyl-ethenyl)cyclopentylidene]ethanoate Openeye Name: methyl (2E)-2-cyano-2-[2-(2,2-dicyano-1-methylsulfanyl-vinyl)cyclopentylidene]acetate CAS Name: (2E)-2-cyano-2-[2-[2,2-dicyano-1-(methylthio)ethenyl]cyclopentylidene]acetic acid methyl ester IUPAC Name: methyl (2E)-2-cyano-2-[2-(2,2-dicyano-1-methylsulfanylethenyl)cyclopentylidene]acetate Traditional Name: (2E)-2-cyano-2-[2-[2,2-dicyano-1-(methylthio)vinyl]cyclopentylidene]acetic acid methyl ester Formula: C14H13N3O2S MolecularWeight: 287.33692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1CCCC1C(=C(C#N)C#N)SC)C#N

Isomeric SMILES

COC(=O)/C(=C/1\CCCC1C(=C(C#N)C#N)SC)/C#N

InChI

InChI=1S/C14H13N3O2S/c1-19-14(18)12(8-17)10-4-3-5-11(10)13(20-2)9(6-15)7-16/h11H,3-5H2,1-2H3/b12-10+