6-ethylsulfanyl-8-methylsulfanyl-9-phenyl-3H-purin-2-one

Systemtic Name: 6-ethylsulfanyl-8-methylsulfanyl-9-phenyl-3H-purin-2-one Openeye Name: 6-ethylsulfanyl-8-methylsulfanyl-9-phenyl-3H-purin-2-one CAS Name: 6-(ethylthio)-8-(methylthio)-9-phenyl-3H-purin-2-one IUPAC Name: 6-ethylsulfanyl-8-methylsulfanyl-9-phenyl-3H-purin-2-one Traditional Name: 6-(ethylthio)-8-(methylthio)-9-phenyl-3H-purin-2-one Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC(=O)NC2=C1N=C(N2C3=CC=CC=C3)SC

Isomeric SMILES

CCSC1=NC(=O)NC2=C1N=C(N2C3=CC=CC=C3)SC

InChI

InChI=1S/C14H14N4OS2/c1-3-21-12-10-11(16-13(19)17-12)18(14(15-10)20-2)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,16,17,19)