2-azanyl-9-[(2S)-2-(hydroxymethyl)-4-oxidanyl-butyl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(2S)-2-(hydroxymethyl)-4-oxidanyl-butyl]-3H-purin-6-one Openeye Name: 2-amino-9-[(2S)-4-hydroxy-2-(hydroxymethyl)butyl]-3H-purin-6-one CAS Name: 2-amino-9-[(2S)-4-hydroxy-2-(hydroxymethyl)butyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(2S)-4-hydroxy-2-(hydroxymethyl)butyl]-3H-purin-6-one Traditional Name: 2-amino-9-[(2S)-4-hydroxy-2-methylol-butyl]-3H-purin-6-one Formula: C10H15N5O3 MolecularWeight: 253.2578

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1CC(CCO)CO)NC(=NC2=O)N

Isomeric SMILES

C1=NC2=C(N1C[C@H](CCO)CO)NC(=NC2=O)N

InChI

InChI=1S/C10H15N5O3/c11-10-13-8-7(9(18)14-10)12-5-15(8)3-6(4-17)1-2-16/h5-6,16-17H,1-4H2,(H3,11,13,14,18)/t6-/m0/s1