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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)COC3=CC=CC=C3)S2)CC(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)COC3=CC=CC=C3)S2)CC(=O)OC

InChI

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