[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyrazine-2-carboxylate

Systemtic Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyrazine-2-carboxylate Openeye Name: [3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyrazine-2-carboxylate CAS Name: 2-pyrazinecarboxylic acid [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methyl pyrazine-2-carboxylate Traditional Name: pyrazinic acid (3-p-cumenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C17H16N4O3 MolecularWeight: 324.33394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=NC=CN=C3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)COC(=O)C3=NC=CN=C3

InChI

InChI=1S/C17H16N4O3/c1-11(2)12-3-5-13(6-4-12)16-20-15(24-21-16)10-23-17(22)14-9-18-7-8-19-14/h3-9,11H,10H2,1-2H3