4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 6-fluoranylpyridine-3-carboxylate

Systemtic Name: 4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 6-fluoranylpyridine-3-carboxylate Openeye Name: 4-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]sulfanyl]but-2-ynyl 6-fluoropyridine-3-carboxylate CAS Name: 6-fluoro-3-pyridinecarboxylic acid 4-[[5-(1-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester IUPAC Name: 4-[(5-naphthalen-1-yl-1,3,4-oxadiazol-2-yl)sulfanyl]but-2-ynyl 6-fluoropyridine-3-carboxylate Traditional Name: 6-fluoronicotinic acid 4-[[5-(1-naphthyl)-1,3,4-oxadiazol-2-yl]thio]but-2-ynyl ester Formula: C22H14FN3O3S MolecularWeight: 419.428263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)SCC#CCOC(=O)C4=CN=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=NN=C(O3)SCC#CCOC(=O)C4=CN=C(C=C4)F

InChI

InChI=1S/C22H14FN3O3S/c23-19-11-10-16(14-24-19)21(27)28-12-3-4-13-30-22-26-25-20(29-22)18-9-5-7-15-6-1-2-8-17(15)18/h1-2,5-11,14H,12-13H2