2-[[2-(3,4-dimethoxyphenyl)ethylamino]-methylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-methylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-methylsulfanyl-methylene]propanedinitrile CAS Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-(methylthio)methylidene]propanedinitrile IUPAC Name: 2-[[2-(3,4-dimethoxyphenyl)ethylamino]-methylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[(homoveratrylamino)-(methylthio)methylene]malononitrile Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=C(C#N)C#N)SC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=C(C#N)C#N)SC)OC

InChI

InChI=1S/C15H17N3O2S/c1-19-13-5-4-11(8-14(13)20-2)6-7-18-15(21-3)12(9-16)10-17/h4-5,8,18H,6-7H2,1-3H3