(2S)-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: (2S)-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: (2S)-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: (2S)-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: (2S)-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: (2S)-2-acetimidoyl-4-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-3-keto-butyronitrile Formula: C13H17N5OS MolecularWeight: 291.37198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)C(C#N)C(=N)C)C2CC2

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)[C@H](C#N)C(=N)C)C2CC2

InChI

InChI=1S/C13H17N5OS/c1-3-18-12(9-4-5-9)16-17-13(18)20-7-11(19)10(6-14)8(2)15/h9-10,15H,3-5,7H2,1-2H3/t10-/m1/s1