2-methylsulfanyl-1,3-benzothiazole thiocyanate

Systemtic Name: 2-methylsulfanyl-1,3-benzothiazole thiocyanate Openeye Name: 2-methylsulfanyl-1,3-benzothiazole thiocyanate CAS Name: 2-(methylthio)-1,3-benzothiazole thiocyanate IUPAC Name: 2-methylsulfanyl-1,3-benzothiazole thiocyanate Traditional Name: 2-(methylthio)-1,3-benzothiazole thiocyanate Formula: C9H7N2S3- MolecularWeight: 239.36028

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=CC=CC=C2S1.C(#N)[S-]

Isomeric SMILES

CSC1=NC2=CC=CC=C2S1.C(#N)[S-]

InChI

InChI=1S/C8H7NS2.CHNS/c1-10-8-9-6-4-2-3-5-7(6)11-8;2-1-3/h2-5H,1H3;3H/p-1