2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[4-(4-fluorophenyl)-4-oxidanylidene-butyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[4-(4-fluorophenyl)-4-oxo-butyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[4-(4-fluorophenyl)-4-oxobutyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[4-(4-fluorophenyl)-4-oxobutyl]sulfanyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[4-(4-fluorophenyl)-4-keto-butyl]thio]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C16H13FN2O2S2 MolecularWeight: 348.415023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCSC2=NC3=C(C=CS3)C(=O)N2)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCSC2=NC3=C(C=CS3)C(=O)N2)F

InChI

InChI=1S/C16H13FN2O2S2/c17-11-5-3-10(4-6-11)13(20)2-1-8-23-16-18-14(21)12-7-9-22-15(12)19-16/h3-7,9H,1-2,8H2,(H,18,19,21)