5-(4-fluorophenyl)-3-methyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-3-methyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-3-methyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-3-methyl-2-[2-(4-morpholin-4-iumyl)ethylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-fluorophenyl)-3-methyl-2-(2-morpholin-4-ium-4-ylethylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-3-methyl-2-(2-morpholin-4-ium-4-ylethylthio)thieno[2,3-d]pyrimidin-4-one Formula: C19H21FN3O2S2+ MolecularWeight: 406.517343

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC[NH+]3CCOCC3)SC=C2C4=CC=C(C=C4)F

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC[NH+]3CCOCC3)SC=C2C4=CC=C(C=C4)F

InChI

InChI=1S/C19H20FN3O2S2/c1-22-18(24)16-15(13-2-4-14(20)5-3-13)12-27-17(16)21-19(22)26-11-8-23-6-9-25-10-7-23/h2-5,12H,6-11H2,1H3/p+1