(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-oxidanylidene-butanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-oxo-butanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-oxobutanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-3-oxobutanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-keto-butyronitrile Formula: C19H14N2O3S2 MolecularWeight: 382.45606

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC(=O)C(=C3NC4=CC=CC=C4S3)C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC(=O)/C(=C/3\NC4=CC=CC=C4S3)/C#N

InChI

InChI=1S/C19H14N2O3S2/c20-10-13(19-21-14-3-1-2-4-18(14)26-19)15(22)11-25-12-5-6-16-17(9-12)24-8-7-23-16/h1-6,9,21H,7-8,11H2/b19-13+