4-[4-azanyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-5-yl]butanenitrile

Systemtic Name: 4-[4-azanyl-1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-2-oxidanylidene-pyrimidin-5-yl]butanenitrile Openeye Name: 4-[4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2-oxo-pyrimidin-5-yl]butanenitrile CAS Name: 4-[4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-2-oxo-5-pyrimidinyl]butanenitrile IUPAC Name: 4-[4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-5-yl]butanenitrile Traditional Name: 4-[4-amino-1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-2-keto-pyrimidin-5-yl]butyronitrile Formula: C13H18N4O5 MolecularWeight: 310.30582

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC(=O)N1C2C(C(C(O2)CO)O)O)N)CCCC#N

Isomeric SMILES

C1=C(C(=NC(=O)N1C2C(C(C(O2)CO)O)O)N)CCCC#N

InChI

InChI=1S/C13H18N4O5/c14-4-2-1-3-7-5-17(13(21)16-11(7)15)12-10(20)9(19)8(6-18)22-12/h5,8-10,12,18-20H,1-3,6H2,(H2,15,16,21)