2-[5-(4-fluorophenyl)-2,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: 2-[5-(4-fluorophenyl)-2,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]sulfanylethanoate Openeye Name: 2-[5-(4-fluorophenyl)-2,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[5-(4-fluorophenyl)-2,6-dimethyl-4-thieno[2,3-d]pyrimidinyl]thio]acetate IUPAC Name: 2-[5-(4-fluorophenyl)-2,6-dimethylthieno[2,3-d]pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[5-(4-fluorophenyl)-2,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]thio]acetate Formula: C16H12FN2O2S2- MolecularWeight: 347.407083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N=C2SCC(=O)[O-])C)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N=C2SCC(=O)[O-])C)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H13FN2O2S2/c1-8-13(10-3-5-11(17)6-4-10)14-15(22-7-12(20)21)18-9(2)19-16(14)23-8/h3-6H,7H2,1-2H3,(H,20,21)/p-1