8-[methoxy(phenyl)methyl]-6-methylsulfanyl-3-propyl-7H-purin-2-one

Systemtic Name: 8-[methoxy(phenyl)methyl]-6-methylsulfanyl-3-propyl-7H-purin-2-one Openeye Name: 8-[methoxy(phenyl)methyl]-6-methylsulfanyl-3-propyl-7H-purin-2-one CAS Name: 8-[methoxy(phenyl)methyl]-6-(methylthio)-3-propyl-7H-purin-2-one IUPAC Name: 8-[methoxy(phenyl)methyl]-6-methylsulfanyl-3-propyl-7H-purin-2-one Traditional Name: 8-[methoxy(phenyl)methyl]-6-(methylthio)-3-propyl-7H-purin-2-one Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC1=O)SC)NC(=N2)C(C3=CC=CC=C3)OC

Isomeric SMILES

CCCN1C2=C(C(=NC1=O)SC)NC(=N2)C(C3=CC=CC=C3)OC

InChI

InChI=1S/C17H20N4O2S/c1-4-10-21-15-12(16(24-3)20-17(21)22)18-14(19-15)13(23-2)11-8-6-5-7-9-11/h5-9,13H,4,10H2,1-3H3,(H,18,19)