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

Systemtic Name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxo-butanenitrile CAS Name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile IUPAC Name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxobutanenitrile Traditional Name: (2Z)-4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-3-keto-2-(3-methyl-1,3-benzothiazol-2-ylidene)butyronitrile Formula: C20H16N2O3S2 MolecularWeight: 396.48264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC1=C(C#N)C(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CN\1C2=CC=CC=C2S/C1=C(/C#N)\C(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H16N2O3S2/c1-22-15-4-2-3-5-19(15)27-20(22)14(11-21)16(23)12-26-13-6-7-17-18(10-13)25-9-8-24-17/h2-7,10H,8-9,12H2,1H3/b20-14-