3,3-bis(methylsulfanyl)-2-(2-oxidanylidene-1,3-benzothiazol-3-yl)prop-2-enenitrile

Systemtic Name: 3,3-bis(methylsulfanyl)-2-(2-oxidanylidene-1,3-benzothiazol-3-yl)prop-2-enenitrile Openeye Name: 3,3-bis(methylsulfanyl)-2-(2-oxo-1,3-benzothiazol-3-yl)prop-2-enenitrile CAS Name: 3,3-bis(methylthio)-2-(2-oxo-1,3-benzothiazol-3-yl)-2-propenenitrile IUPAC Name: 3,3-bis(methylsulfanyl)-2-(2-oxo-1,3-benzothiazol-3-yl)prop-2-enenitrile Traditional Name: 2-(2-keto-1,3-benzothiazol-3-yl)-3,3-bis(methylthio)acrylonitrile Formula: C12H10N2OS3 MolecularWeight: 294.4156

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=C(C#N)N1C2=CC=CC=C2SC1=O)SC

Isomeric SMILES

CSC(=C(C#N)N1C2=CC=CC=C2SC1=O)SC

InChI

InChI=1S/C12H10N2OS3/c1-16-11(17-2)9(7-13)14-8-5-3-4-6-10(8)18-12(14)15/h3-6H,1-2H3