2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(1-propylimidazol-2-yl)sulfanyl-butanenitrile

Systemtic Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxidanylidene-4-(1-propylimidazol-2-yl)sulfanyl-butanenitrile Openeye Name: 2-(4-methylthiazol-2-yl)-3-oxo-4-(1-propylimidazol-2-yl)sulfanyl-butanenitrile CAS Name: 2-(4-methyl-2-thiazolyl)-3-oxo-4-[(1-propyl-2-imidazolyl)thio]butanenitrile IUPAC Name: 2-(4-methyl-1,3-thiazol-2-yl)-3-oxo-4-(1-propylimidazol-2-yl)sulfanylbutanenitrile Traditional Name: 3-keto-2-(4-methylthiazol-2-yl)-4-[(1-propylimidazol-2-yl)thio]butyronitrile Formula: C14H16N4OS2 MolecularWeight: 320.43304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SCC(=O)C(C#N)C2=NC(=CS2)C

Isomeric SMILES

CCCN1C=CN=C1SCC(=O)C(C#N)C2=NC(=CS2)C

InChI

InChI=1S/C14H16N4OS2/c1-3-5-18-6-4-16-14(18)21-9-12(19)11(7-15)13-17-10(2)8-20-13/h4,6,8,11H,3,5,9H2,1-2H3