[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2,1,3-benzothiadiazole-5-carboxylate

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2,1,3-benzothiadiazole-5-carboxylate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl 2,1,3-benzothiadiazole-5-carboxylate CAS Name: 2,1,3-benzothiadiazole-5-carboxylic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 2,1,3-benzothiadiazole-5-carboxylate Traditional Name: piazthiole-5-carboxylic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C19H15N3O5S MolecularWeight: 397.4045

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC4=NSN=C4C=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC4=NSN=C4C=C3)OC

InChI

InChI=1S/C19H15N3O5S/c1-24-16-6-4-11(8-18(16)25-2)17-9-13(20-27-17)10-26-19(23)12-3-5-14-15(7-12)22-28-21-14/h3-9H,10H2,1-2H3