8-(2-methoxy-4-methylsulfinyl-phenyl)purin-2-one hydrochloride

Systemtic Name: 8-(2-methoxy-4-methylsulfinyl-phenyl)purin-2-one hydrochloride Openeye Name: 8-(2-methoxy-4-methylsulfinyl-phenyl)purin-2-one hydrochloride CAS Name: 8-(2-methoxy-4-methylsulfinylphenyl)-2-purinone hydrochloride IUPAC Name: 8-(2-methoxy-4-methylsulfinylphenyl)purin-2-one hydrochloride Traditional Name: 8-(2-methoxy-4-methylsulfinyl-phenyl)purin-2-one hydrochloride Formula: C13H11ClN4O3S MolecularWeight: 338.76944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)S(=O)C)C2=NC3=NC(=O)N=CC3=N2.Cl

Isomeric SMILES

COC1=C(C=CC(=C1)S(=O)C)C2=NC3=NC(=O)N=CC3=N2.Cl

InChI

InChI=1S/C13H10N4O3S.ClH/c1-20-10-5-7(21(2)19)3-4-8(10)11-15-9-6-14-13(18)17-12(9)16-11;/h3-6H,1-2H3;1H