8-azanyl-2-propan-2-yl-purin-6-one

Systemtic Name: 8-azanyl-2-propan-2-yl-purin-6-one Openeye Name: 8-amino-2-isopropyl-purin-6-one CAS Name: 8-amino-2-propan-2-yl-6-purinone IUPAC Name: 8-amino-2-propan-2-ylpurin-6-one Traditional Name: 8-amino-2-isopropyl-purin-6-one Formula: C8H9N5O MolecularWeight: 191.18996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)C2=NC(=NC2=N1)N

Isomeric SMILES

CC(C)C1=NC(=O)C2=NC(=NC2=N1)N

InChI

InChI=1S/C8H9N5O/c1-3(2)5-11-6-4(7(14)12-5)10-8(9)13-6/h3H,1-2H3,(H2,9,11,12,13,14)