8-methylsulfanyl-9-phenyl-3H-purine-2,6-dione

Systemtic Name: 8-methylsulfanyl-9-phenyl-3H-purine-2,6-dione Openeye Name: 8-methylsulfanyl-9-phenyl-3H-purine-2,6-dione CAS Name: 8-(methylthio)-9-phenyl-3H-purine-2,6-dione IUPAC Name: 8-methylsulfanyl-9-phenyl-3H-purine-2,6-dione Traditional Name: 8-(methylthio)-9-phenyl-xanthine Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(N1C3=CC=CC=C3)NC(=O)NC2=O

Isomeric SMILES

CSC1=NC2=C(N1C3=CC=CC=C3)NC(=O)NC2=O

InChI

InChI=1S/C12H10N4O2S/c1-19-12-13-8-9(14-11(18)15-10(8)17)16(12)7-5-3-2-4-6-7/h2-6H,1H3,(H2,14,15,17,18)