propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-(2-fluorophenyl)-4-propyl-pyridine-3-carboxylate

Systemtic Name: propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-(2-fluorophenyl)-4-propyl-pyridine-3-carboxylate Openeye Name: propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-(2-fluorophenyl)-4-propyl-pyridine-3-carboxylate CAS Name: 6-ethyl-5-[(ethylthio)-oxomethyl]-2-(2-fluorophenyl)-4-propyl-3-pyridinecarboxylic acid propyl ester IUPAC Name: propyl 6-ethyl-5-ethylsulfanylcarbonyl-2-(2-fluorophenyl)-4-propylpyridine-3-carboxylate Traditional Name: 6-ethyl-5-(ethylthio)carbonyl-2-(2-fluorophenyl)-4-propyl-nicotinic acid propyl ester Formula: C23H28FNO3S MolecularWeight: 417.536723

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=NC(=C1C(=O)SCC)CC)C2=CC=CC=C2F)C(=O)OCCC

Isomeric SMILES

CCCC1=C(C(=NC(=C1C(=O)SCC)CC)C2=CC=CC=C2F)C(=O)OCCC

InChI

InChI=1S/C23H28FNO3S/c1-5-11-16-19(23(27)29-8-4)18(7-3)25-21(15-12-9-10-13-17(15)24)20(16)22(26)28-14-6-2/h9-10,12-13H,5-8,11,14H2,1-4H3