4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-[[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]-3-keto-butyronitrile Formula: C16H16N4O4S MolecularWeight: 360.38764

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=NN=C(O1)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=NN=C(O1)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H16N4O4S/c1-9(18)11(7-17)12(21)8-25-16-20-19-15(24-16)10-4-5-13(22-2)14(6-10)23-3/h4-6,11,18H,8H2,1-3H3