methyl 2-[2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-6-methylsulfanyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[2-(4-methoxyphenyl)sulfonyl-1-oxoethyl]imino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-6-methylsulfanyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-6-(methylthio)-1,3-benzothiazol-3-yl]acetic acid methyl ester Formula: C20H20N2O6S3 MolecularWeight: 480.5776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)CC(=O)N=C2N(C3=C(S2)C=C(C=C3)SC)CC(=O)OC

InChI

InChI=1S/C20H20N2O6S3/c1-27-13-4-7-15(8-5-13)31(25,26)12-18(23)21-20-22(11-19(24)28-2)16-9-6-14(29-3)10-17(16)30-20/h4-10H,11-12H2,1-3H3