4-[(5-ethyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)carbonyl]benzenecarbonitrile

Systemtic Name: 4-[(5-ethyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)carbonyl]benzenecarbonitrile Openeye Name: 4-(5-ethyl-2-thioxo-1,3-dihydroimidazole-4-carbonyl)benzonitrile CAS Name: 4-[(5-ethyl-2-sulfanylidene-1,3-dihydroimidazol-4-yl)-oxomethyl]benzonitrile IUPAC Name: 4-(5-ethyl-2-sulfanylidene-1,3-dihydroimidazole-4-carbonyl)benzonitrile Traditional Name: 4-(5-ethyl-2-thioxo-4-imidazoline-4-carbonyl)benzonitrile Formula: C13H11N3OS MolecularWeight: 257.31094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=S)N1)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=C(NC(=S)N1)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C13H11N3OS/c1-2-10-11(16-13(18)15-10)12(17)9-5-3-8(7-14)4-6-9/h3-6H,2H2,1H3,(H2,15,16,18)