methyl 2-sulfanylidene-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-sulfanylidene-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-thioxo-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylate CAS Name: 2-sulfanylidene-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-sulfanylidene-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylate Traditional Name: 2-thioxo-4,5,6,7-tetrahydro-3H-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C9H11NO2S2 MolecularWeight: 229.31914

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC2=C(C1)SC(=S)N2

Isomeric SMILES

COC(=O)C1CCC2=C(C1)SC(=S)N2

InChI

InChI=1S/C9H11NO2S2/c1-12-8(11)5-2-3-6-7(4-5)14-9(13)10-6/h5H,2-4H2,1H3,(H,10,13)