methyl 2-sulfanylidene-3H-1,3-benzothiazole-7-carboxylate

Systemtic Name: methyl 2-sulfanylidene-3H-1,3-benzothiazole-7-carboxylate Openeye Name: methyl 2-thioxo-3H-1,3-benzothiazole-7-carboxylate CAS Name: 2-sulfanylidene-3H-1,3-benzothiazole-7-carboxylic acid methyl ester IUPAC Name: methyl 2-sulfanylidene-3H-1,3-benzothiazole-7-carboxylate Traditional Name: 2-thioxo-3H-1,3-benzothiazole-7-carboxylic acid methyl ester Formula: C9H7NO2S2 MolecularWeight: 225.28738

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=CC=C1)NC(=S)S2

Isomeric SMILES

COC(=O)C1=C2C(=CC=C1)NC(=S)S2

InChI

InChI=1S/C9H7NO2S2/c1-12-8(11)5-3-2-4-6-7(5)14-9(13)10-6/h2-4H,1H3,(H,10,13)