methyl 2-(2-ethanoylimino-6-methylsulfanyl-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(2-ethanoylimino-6-methylsulfanyl-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(2-acetylimino-6-methylsulfanyl-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[2-acetylimino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(2-acetylimino-6-methylsulfanyl-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-[2-acetylimino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC(=O)OC

Isomeric SMILES

CC(=O)N=C1N(C2=C(S1)C=C(C=C2)SC)CC(=O)OC

InChI

InChI=1S/C13H14N2O3S2/c1-8(16)14-13-15(7-12(17)18-2)10-5-4-9(19-3)6-11(10)20-13/h4-6H,7H2,1-3H3