2-azanyl-5-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-5-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-[(4-fluorophenyl)methylthio]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-5-[(4-fluorophenyl)methylsulfanyl]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-[(4-fluorobenzyl)thio]-6-methyl-1,7-dihydropyrrolo[2,3-d]pyrimidin-4-one Formula: C14H13FN4OS MolecularWeight: 304.342623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)NC(=NC2=O)N)SCC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C2=C(N1)NC(=NC2=O)N)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C14H13FN4OS/c1-7-11(21-6-8-2-4-9(15)5-3-8)10-12(17-7)18-14(16)19-13(10)20/h2-5H,6H2,1H3,(H4,16,17,18,19,20)