6-methylsulfanyl-3-propyl-7H-purin-2-one

Systemtic Name: 6-methylsulfanyl-3-propyl-7H-purin-2-one Openeye Name: 6-methylsulfanyl-3-propyl-7H-purin-2-one CAS Name: 6-(methylthio)-3-propyl-7H-purin-2-one IUPAC Name: 6-methylsulfanyl-3-propyl-7H-purin-2-one Traditional Name: 6-(methylthio)-3-propyl-7H-purin-2-one Formula: C9H12N4OS MolecularWeight: 224.28278

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC1=O)SC)NC=N2

Isomeric SMILES

CCCN1C2=C(C(=NC1=O)SC)NC=N2

InChI

InChI=1S/C9H12N4OS/c1-3-4-13-7-6(10-5-11-7)8(15-2)12-9(13)14/h5H,3-4H2,1-2H3,(H,10,11)