2-azanyl-5-hex-1-ynyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1H-pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-5-hex-1-ynyl-7-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-1H-pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-hex-1-ynyl-7-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1H-pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-hex-1-ynyl-7-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-1H-pyrrolo[2,3-d]pyrimidin-4-one IUPAC Name: 2-amino-5-hex-1-ynyl-7-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-hex-1-ynyl-7-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-1H-pyrrolo[2,3-d]pyrimidin-4-one Formula: C17H22N4O4 MolecularWeight: 346.38098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CN(C2=C1C(=O)N=C(N2)N)C3CC(C(O3)CO)O

Isomeric SMILES

CCCCC#CC1=CN(C2=C1C(=O)N=C(N2)N)C3CC(C(O3)CO)O

InChI

InChI=1S/C17H22N4O4/c1-2-3-4-5-6-10-8-21(13-7-11(23)12(9-22)25-13)15-14(10)16(24)20-17(18)19-15/h8,11-13,22-23H,2-4,7,9H2,1H3,(H3,18,19,20,24)