4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-ethanimidoyl-3-oxidanylidene-butanenitrile

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-ethanimidoyl-3-oxidanylidene-butanenitrile Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-ethanimidoyl-3-oxo-butanenitrile CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-(1-iminoethyl)-3-oxobutanenitrile IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-ethanimidoyl-3-oxobutanenitrile Traditional Name: 2-acetimidoyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-keto-butyronitrile Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)CSC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CC(=N)C(C#N)C(=O)CSC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C14H14N2O3S/c1-9(16)11(7-15)12(17)8-20-10-2-3-13-14(6-10)19-5-4-18-13/h2-3,6,11,16H,4-5,8H2,1H3