ethyl 2-[5,6-dimethoxy-2-(1,2-oxazol-5-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[5,6-dimethoxy-2-(1,2-oxazol-5-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(isoxazole-5-carbonylimino)-5,6-dimethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[5-isoxazolyl(oxo)methyl]imino-5,6-dimethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5,6-dimethoxy-2-(1,2-oxazole-5-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-(isoxazole-5-carbonylimino)-5,6-dimethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC(=C(C=C2SC1=NC(=O)C3=CC=NO3)OC)OC

Isomeric SMILES

CCOC(=O)CN1C2=CC(=C(C=C2SC1=NC(=O)C3=CC=NO3)OC)OC

InChI

InChI=1S/C17H17N3O6S/c1-4-25-15(21)9-20-10-7-12(23-2)13(24-3)8-14(10)27-17(20)19-16(22)11-5-6-18-26-11/h5-8H,4,9H2,1-3H3