ethyl 2-[2-(2-ethanoylsulfonylethanoylimino)-6-methyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(2-ethanoylsulfonylethanoylimino)-6-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(2-acetylsulfonylacetyl)imino-6-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-(2-acetylsulfonyl-1-oxoethyl)imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2-acetylsulfonylacetyl)imino-6-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(2-acetylsulfonylacetyl)imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C16H18N2O6S2 MolecularWeight: 398.45392

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C)SC1=NC(=O)CS(=O)(=O)C(=O)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C)SC1=NC(=O)CS(=O)(=O)C(=O)C

InChI

InChI=1S/C16H18N2O6S2/c1-4-24-15(21)8-18-12-6-5-10(2)7-13(12)25-16(18)17-14(20)9-26(22,23)11(3)19/h5-7H,4,8-9H2,1-3H3