pyridin-2-ylmethyl 4-fluoranyl-3-methyl-1-benzothiophene-2-carboxylate

Systemtic Name: pyridin-2-ylmethyl 4-fluoranyl-3-methyl-1-benzothiophene-2-carboxylate Openeye Name: 2-pyridylmethyl 4-fluoro-3-methyl-benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-methyl-1-benzothiophene-2-carboxylic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl 4-fluoro-3-methyl-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-methyl-benzothiophene-2-carboxylic acid 2-pyridylmethyl ester Formula: C16H12FNO2S MolecularWeight: 301.335383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)OCC3=CC=CC=N3

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)OCC3=CC=CC=N3

InChI

InChI=1S/C16H12FNO2S/c1-10-14-12(17)6-4-7-13(14)21-15(10)16(19)20-9-11-5-2-3-8-18-11/h2-8H,9H2,1H3