ethanedioic acid; 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridine

Systemtic Name: ethanedioic acid; 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridine Openeye Name: 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methyl-pyridine; oxalic acid CAS Name: 5-[2-[(4-fluorophenyl)thio]ethyl]-2-methylpyridine; oxalic acid IUPAC Name: 5-[2-(4-fluorophenyl)sulfanylethyl]-2-methylpyridine; oxalic acid Traditional Name: 5-[2-[(4-fluorophenyl)thio]ethyl]-2-methyl-pyridine; oxalic acid Formula: C16H16FNO4S MolecularWeight: 337.365943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)CCSC2=CC=C(C=C2)F.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=NC=C(C=C1)CCSC2=CC=C(C=C2)F.C(=O)(C(=O)O)O

InChI

InChI=1S/C14H14FNS.C2H2O4/c1-11-2-3-12(10-16-11)8-9-17-14-6-4-13(15)5-7-14;3-1(4)2(5)6/h2-7,10H,8-9H2,1H3;(H,3,4)(H,5,6)