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

Systemtic Name: ethyl 2-[6-ethoxy-2-(1,2-oxazol-5-ylcarbonylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-ethoxy-2-(isoxazole-5-carbonylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-ethoxy-2-[5-isoxazolyl(oxo)methyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-ethoxy-2-(1,2-oxazole-5-carbonylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-ethoxy-2-(isoxazole-5-carbonylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=NO3)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=NO3)S2)CC(=O)OCC

InChI

InChI=1S/C17H17N3O5S/c1-3-23-11-5-6-12-14(9-11)26-17(20(12)10-15(21)24-4-2)19-16(22)13-7-8-18-25-13/h5-9H,3-4,10H2,1-2H3