3-methylsulfanyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-5-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-2H-1,2-thiazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-isothiazole-4-carbonitrile CAS Name: 3-(methylthio)-5-(4-oxo-1-cyclohexa-2,5-dienylidene)-2H-isothiazole-4-carbonitrile IUPAC Name: 3-methylsulfanyl-5-(4-oxocyclohexa-2,5-dien-1-ylidene)-2H-1,2-thiazole-4-carbonitrile Traditional Name: 5-(4-ketocyclohexa-2,5-dien-1-ylidene)-3-(methylthio)-3-isothiazoline-4-carbonitrile Formula: C11H8N2OS2 MolecularWeight: 248.32402

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=C2C=CC(=O)C=C2)SN1)C#N

Isomeric SMILES

CSC1=C(C(=C2C=CC(=O)C=C2)SN1)C#N

InChI

InChI=1S/C11H8N2OS2/c1-15-11-9(6-12)10(16-13-11)7-2-4-8(14)5-3-7/h2-5,13H,1H3