methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-(2-phenoxyethanoylimino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 3-(2-ethoxy-2-oxidanylidene-ethyl)-2-(2-phenoxyethanoylimino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 3-(2-ethoxy-2-oxo-ethyl)-2-(2-phenoxyacetyl)imino-1,3-benzothiazole-6-carboxylate CAS Name: 3-(2-ethoxy-2-oxoethyl)-2-(1-oxo-2-phenoxyethyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-ethoxy-2-oxoethyl)-2-(2-phenoxyacetyl)imino-1,3-benzothiazole-6-carboxylate Traditional Name: 3-(2-ethoxy-2-keto-ethyl)-2-(2-phenoxyacetyl)imino-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C21H20N2O6S MolecularWeight: 428.4583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C(=O)OC)SC1=NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O6S/c1-3-28-19(25)12-23-16-10-9-14(20(26)27-2)11-17(16)30-21(23)22-18(24)13-29-15-7-5-4-6-8-15/h4-11H,3,12-13H2,1-2H3