(2S)-2-ethanimidoyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-2-ethanimidoyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: (2S)-2-ethanimidoyl-4-[[5-(2-methylallylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxo-butanenitrile CAS Name: (2S)-2-(1-iminoethyl)-4-[[5-(2-methylprop-2-enylthio)-1,3,4-thiadiazol-2-yl]thio]-3-oxobutanenitrile IUPAC Name: (2S)-2-ethanimidoyl-4-[[5-(2-methylprop-2-enylsulfanyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-oxobutanenitrile Traditional Name: (2S)-2-acetimidoyl-3-keto-4-[[5-(2-methylallylthio)-1,3,4-thiadiazol-2-yl]thio]butyronitrile Formula: C12H14N4OS3 MolecularWeight: 326.46076

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CSC1=NN=C(S1)SCC(=O)C(C#N)C(=N)C

Isomeric SMILES

CC(=C)CSC1=NN=C(S1)SCC(=O)[C@H](C#N)C(=N)C

InChI

InChI=1S/C12H14N4OS3/c1-7(2)5-18-11-15-16-12(20-11)19-6-10(17)9(4-13)8(3)14/h9,14H,1,5-6H2,2-3H3/t9-/m1/s1