4-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[[5-[(2,3-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[5-(2,3-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-3-keto-butyronitrile Formula: C16H17N5OS2 MolecularWeight: 359.46908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=NN=C(S2)SCC(=O)C(C#N)C(=N)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=NN=C(S2)SCC(=O)C(C#N)C(=N)C)C

InChI

InChI=1S/C16H17N5OS2/c1-9-5-4-6-13(10(9)2)19-15-20-21-16(24-15)23-8-14(22)12(7-17)11(3)18/h4-6,12,18H,8H2,1-3H3,(H,19,20)