3,7-dimethyl-6-(1-oxidanylbutan-2-ylamino)purin-2-one

Systemtic Name: 3,7-dimethyl-6-(1-oxidanylbutan-2-ylamino)purin-2-one Openeye Name: 6-[1-(hydroxymethyl)propylamino]-3,7-dimethyl-purin-2-one CAS Name: 6-(1-hydroxybutan-2-ylamino)-3,7-dimethyl-2-purinone IUPAC Name: 6-(1-hydroxybutan-2-ylamino)-3,7-dimethylpurin-2-one Traditional Name: 3,7-dimethyl-6-(1-methylolpropylamino)purin-2-one Formula: C11H17N5O2 MolecularWeight: 251.28498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC(=O)N(C2=C1N(C=N2)C)C

Isomeric SMILES

CCC(CO)NC1=NC(=O)N(C2=C1N(C=N2)C)C

InChI

InChI=1S/C11H17N5O2/c1-4-7(5-17)13-9-8-10(12-6-15(8)2)16(3)11(18)14-9/h6-7,17H,4-5H2,1-3H3,(H,13,14,18)