2-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-hexyl-ethanamide

Systemtic Name: 2-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-hexyl-ethanamide Openeye Name: 2-[5-(4-fluorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]-N-hexyl-acetamide CAS Name: 2-[5-(4-fluorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-hexylacetamide IUPAC Name: 2-[5-(4-fluorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-hexylacetamide Traditional Name: 2-[5-(4-fluorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]-N-hexyl-acetamide Formula: C20H22FN3O2S MolecularWeight: 387.470983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCNC(=O)CN1C=NC2=C(C1=O)C(=CS2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H22FN3O2S/c1-2-3-4-5-10-22-17(25)11-24-13-23-19-18(20(24)26)16(12-27-19)14-6-8-15(21)9-7-14/h6-9,12-13H,2-5,10-11H2,1H3,(H,22,25)