(4-pyrazol-1-ylphenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl 3-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl 3-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propanoate CAS Name: 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl 3-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)propanoate Traditional Name: 3-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]propionic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)CCN3C(=O)OC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)COC(=O)CCN3C(=O)OC(=N3)C4=CC=CS4

InChI

InChI=1S/C19H16N4O4S/c24-17(8-11-23-19(25)27-18(21-23)16-3-1-12-28-16)26-13-14-4-6-15(7-5-14)22-10-2-9-20-22/h1-7,9-10,12H,8,11,13H2