methyl 2-cyano-2H-1,3-benzothiazole-3-carboxylate

Systemtic Name: methyl 2-cyano-2H-1,3-benzothiazole-3-carboxylate Openeye Name: methyl 2-cyano-2H-1,3-benzothiazole-3-carboxylate CAS Name: 2-cyano-2H-1,3-benzothiazole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-cyano-2H-1,3-benzothiazole-3-carboxylate Traditional Name: 2-cyano-2H-1,3-benzothiazole-3-carboxylic acid methyl ester Formula: C10H8N2O2S MolecularWeight: 220.24772

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(SC2=CC=CC=C21)C#N

Isomeric SMILES

COC(=O)N1C(SC2=CC=CC=C21)C#N

InChI

InChI=1S/C10H8N2O2S/c1-14-10(13)12-7-4-2-3-5-8(7)15-9(12)6-11/h2-5,9H,1H3