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

Systemtic Name: 2-[[5-(4-fluorophenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-hexyl-ethanamide Openeye Name: 2-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-hexyl-acetamide CAS Name: 2-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]thio]-N-hexylacetamide IUPAC Name: 2-[[5-(4-fluorophenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl]-N-hexylacetamide Traditional Name: 2-[[5-(4-fluorophenyl)-4-keto-3H-thieno[2,3-d]pyrimidin-2-yl]thio]-N-hexyl-acetamide Formula: C20H22FN3O2S2 MolecularWeight: 419.535983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)N1

Isomeric SMILES

CCCCCCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=C(C=C3)F)C(=O)N1

InChI

InChI=1S/C20H22FN3O2S2/c1-2-3-4-5-10-22-16(25)12-28-20-23-18(26)17-15(11-27-19(17)24-20)13-6-8-14(21)9-7-13/h6-9,11H,2-5,10,12H2,1H3,(H,22,25)(H,23,24,26)