(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 5-phenyl-1H-pyrazole-4-carboxylate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 5-phenyl-1H-pyrazole-4-carboxylate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 5-phenyl-1H-pyrazole-4-carboxylate CAS Name: 5-phenyl-1H-pyrazole-4-carboxylic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 5-phenyl-1H-pyrazole-4-carboxylate Traditional Name: 5-phenyl-1H-pyrazole-4-carboxylic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C17H12N4O3S MolecularWeight: 352.36718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C(=O)OCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)C(=O)OCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C17H12N4O3S/c22-17(12-9-18-20-15(12)11-5-2-1-3-6-11)23-10-14-19-16(21-24-14)13-7-4-8-25-13/h1-9H,10H2,(H,18,20)