2-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-2-propyl-oxolan-2-yl]-1-imidazol-1-yl-purin-6-one

Systemtic Name: 2-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-2-propyl-oxolan-2-yl]-1-imidazol-1-yl-purin-6-one Openeye Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-propyl-tetrahydrofuran-2-yl]-1-imidazol-1-yl-purin-6-one CAS Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-propyl-2-oxolanyl]-1-(1-imidazolyl)-6-purinone IUPAC Name: 2-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-propyloxolan-2-yl]-1-imidazol-1-ylpurin-6-one Traditional Name: 2-amino-9-(4-hydroxy-5-methylol-2-propyl-tetrahydrofuran-2-yl)-1-imidazol-1-yl-purin-6-one Formula: C16H21N7O4 MolecularWeight: 375.38244

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CC(C(O1)CO)O)N2C=NC3=C2N=C(N(C3=O)N4C=CN=C4)N

Isomeric SMILES

CCCC1(CC(C(O1)CO)O)N2C=NC3=C2N=C(N(C3=O)N4C=CN=C4)N

InChI

InChI=1S/C16H21N7O4/c1-2-3-16(6-10(25)11(7-24)27-16)22-9-19-12-13(22)20-15(17)23(14(12)26)21-5-4-18-8-21/h4-5,8-11,24-25H,2-3,6-7H2,1H3,(H2,17,20)