[2-fluoranyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] heptanoate

Systemtic Name: [2-fluoranyl-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] heptanoate Openeye Name: [2-fluoro-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] heptanoate CAS Name: heptanoic acid [2-fluoro-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] ester IUPAC Name: [2-fluoro-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] heptanoate Traditional Name: enanthic acid [2-fluoro-4-(5-hexyl-1,3,4-thiadiazol-2-yl)phenyl] ester Formula: C21H29FN2O2S MolecularWeight: 392.530563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=NN=C(S1)C2=CC(=C(C=C2)OC(=O)CCCCCC)F

Isomeric SMILES

CCCCCCC1=NN=C(S1)C2=CC(=C(C=C2)OC(=O)CCCCCC)F

InChI

InChI=1S/C21H29FN2O2S/c1-3-5-7-9-11-19-23-24-21(27-19)16-13-14-18(17(22)15-16)26-20(25)12-10-8-6-4-2/h13-15H,3-12H2,1-2H3