(2-fluorophenyl) 5-hexyl-4-(5-undecylpyrimidin-2-yl)thiophene-2-carboxylate

Systemtic Name: (2-fluorophenyl) 5-hexyl-4-(5-undecylpyrimidin-2-yl)thiophene-2-carboxylate Openeye Name: (2-fluorophenyl) 5-hexyl-4-(5-undecylpyrimidin-2-yl)thiophene-2-carboxylate CAS Name: 5-hexyl-4-(5-undecyl-2-pyrimidinyl)-2-thiophenecarboxylic acid (2-fluorophenyl) ester IUPAC Name: (2-fluorophenyl) 5-hexyl-4-(5-undecylpyrimidin-2-yl)thiophene-2-carboxylate Traditional Name: 5-hexyl-4-(5-undecylpyrimidin-2-yl)thiophene-2-carboxylic acid (2-fluorophenyl) ester Formula: C32H43FN2O2S MolecularWeight: 538.759423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=CN=C(N=C1)C2=C(SC(=C2)C(=O)OC3=CC=CC=C3F)CCCCCC

Isomeric SMILES

CCCCCCCCCCCC1=CN=C(N=C1)C2=C(SC(=C2)C(=O)OC3=CC=CC=C3F)CCCCCC

InChI

InChI=1S/C32H43FN2O2S/c1-3-5-7-9-10-11-12-13-14-18-25-23-34-31(35-24-25)26-22-30(38-29(26)21-15-8-6-4-2)32(36)37-28-20-17-16-19-27(28)33/h16-17,19-20,22-24H,3-15,18,21H2,1-2H3