[5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate

Systemtic Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate Openeye Name: [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl 5-(2-thienyl)-1H-pyrazole-3-carboxylate CAS Name: 5-thiophen-2-yl-1H-pyrazole-3-carboxylic acid [5-(1,3-benzodioxol-5-yl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(1,3-benzodioxol-5-yl)-1,2-oxazol-3-yl]methyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate Traditional Name: 5-(2-thienyl)-1H-pyrazole-3-carboxylic acid [5-(1,3-benzodioxol-5-yl)isoxazol-3-yl]methyl ester Formula: C19H13N3O5S MolecularWeight: 395.38862

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)COC(=O)C4=NNC(=C4)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC(=NO3)COC(=O)C4=NNC(=C4)C5=CC=CS5

InChI

InChI=1S/C19H13N3O5S/c23-19(14-8-13(20-21-14)18-2-1-5-28-18)24-9-12-7-16(27-22-12)11-3-4-15-17(6-11)26-10-25-15/h1-8H,9-10H2,(H,20,21)