[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoranyl-1-benzothiophene-2-carboxylate

Systemtic Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoranyl-1-benzothiophene-2-carboxylate Openeye Name: (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl 4-fluorobenzothiophene-2-carboxylate CAS Name: 4-fluoro-1-benzothiophene-2-carboxylic acid [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methyl 4-fluoro-1-benzothiophene-2-carboxylate Traditional Name: 4-fluorobenzothiophene-2-carboxylic acid (3-isobutyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C16H15FN2O3S MolecularWeight: 334.365303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NOC(=N1)COC(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CC(C)CC1=NOC(=N1)COC(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C16H15FN2O3S/c1-9(2)6-14-18-15(22-19-14)8-21-16(20)13-7-10-11(17)4-3-5-12(10)23-13/h3-5,7,9H,6,8H2,1-2H3