4-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[[5-[(2,6-dimethylphenyl)amino]-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[5-(2,6-dimethylanilino)-1,3,4-thiadiazol-2-yl]thio]-3-keto-butyronitrile Formula: C16H17N5OS2 MolecularWeight: 359.46908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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