8-[3-(4-fluorophenyl)propylsulfanyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

Systemtic Name: 8-[3-(4-fluorophenyl)propylsulfanyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Openeye Name: 8-[3-(4-fluorophenyl)propylsulfanyl]-1,3-dimethyl-6-thioxo-7H-purin-2-one CAS Name: 8-[3-(4-fluorophenyl)propylthio]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one IUPAC Name: 8-[3-(4-fluorophenyl)propylsulfanyl]-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one Traditional Name: 8-[3-(4-fluorophenyl)propylthio]-1,3-dimethyl-6-thioxo-7H-purin-2-one Formula: C16H17FN4OS2 MolecularWeight: 364.460783

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=S)N(C1=O)C)NC(=N2)SCCCC3=CC=C(C=C3)F

Isomeric SMILES

CN1C2=C(C(=S)N(C1=O)C)NC(=N2)SCCCC3=CC=C(C=C3)F

InChI

InChI=1S/C16H17FN4OS2/c1-20-13-12(14(23)21(2)16(20)22)18-15(19-13)24-9-3-4-10-5-7-11(17)8-6-10/h5-8H,3-4,9H2,1-2H3,(H,18,19)