(5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C18H14N4O3S MolecularWeight: 366.39376

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4

Isomeric SMILES

C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)OCC3=NOC(=N3)C4=CSC=C4

InChI

InChI=1S/C18H14N4O3S/c23-18(14-4-2-13(3-5-14)10-22-8-1-7-19-22)24-11-16-20-17(25-21-16)15-6-9-26-12-15/h1-9,12H,10-11H2