ethyl 2-(1,3-benzothiazol-2-yl)-5-oxidanylidene-1,2-oxazole-4-carboxylate

Systemtic Name: ethyl 2-(1,3-benzothiazol-2-yl)-5-oxidanylidene-1,2-oxazole-4-carboxylate Openeye Name: ethyl 2-(1,3-benzothiazol-2-yl)-5-oxo-isoxazole-4-carboxylate CAS Name: 2-(1,3-benzothiazol-2-yl)-5-oxo-4-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(1,3-benzothiazol-2-yl)-5-oxo-1,2-oxazole-4-carboxylate Traditional Name: 2-(1,3-benzothiazol-2-yl)-5-keto-3-isoxazoline-4-carboxylic acid ethyl ester Formula: C13H10N2O4S MolecularWeight: 290.2945

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(OC1=O)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC(=O)C1=CN(OC1=O)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C13H10N2O4S/c1-2-18-11(16)8-7-15(19-12(8)17)13-14-9-5-3-4-6-10(9)20-13/h3-7H,2H2,1H3