methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-[2-(4-methoxyphenyl)sulfonylethanoylimino]-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxy-2-oxo-ethyl)-2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-[2-(4-methoxyphenyl)sulfonyl-1-oxoethyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxy-2-oxoethyl)-2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-[2-(4-methoxyphenyl)sulfonylacetyl]imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C22H22N2O8S2 MolecularWeight: 506.54868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)CS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22N2O8S2/c1-4-32-20(26)12-24-17-10-5-14(21(27)31-3)11-18(17)33-22(24)23-19(25)13-34(28,29)16-8-6-15(30-2)7-9-16/h5-11H,4,12-13H2,1-3H3