2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-methylsulfanyl-methylidene]propanedinitrile

Systemtic Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-methylsulfanyl-methylidene]propanedinitrile Openeye Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-methylsulfanyl-methylene]propanedinitrile CAS Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-(methylthio)methylidene]propanedinitrile IUPAC Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethylamino]-methylsulfanylmethylidene]propanedinitrile Traditional Name: 2-[[2-[(5-methyl-1H-imidazol-4-yl)methylthio]ethylamino]-(methylthio)methylene]malononitrile Formula: C12H15N5S2 MolecularWeight: 293.411

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CN1)CSCCNC(=C(C#N)C#N)SC

Isomeric SMILES

CC1=C(N=CN1)CSCCNC(=C(C#N)C#N)SC

InChI

InChI=1S/C12H15N5S2/c1-9-11(17-8-16-9)7-19-4-3-15-12(18-2)10(5-13)6-14/h8,15H,3-4,7H2,1-2H3,(H,16,17)