AX1

2-amino-6-(1,3-benzodioxol-5-yl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile


Toggle HydrogenToggle Labels

Chemical Component Summary

Name2-amino-6-(1,3-benzodioxol-5-yl)-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile
Identifiers2-amino-6-(1,3-benzodioxol-5-yl)-4-oxo-3,7-dihydropyrrolo[5,4-d]pyrimidine-5-carbonitrile
FormulaC14 H9 N5 O3
Molecular Weight295.253
TypeNON-POLYMER
Isomeric SMILESc1cc2c(cc1c3c(c4c([nH]3)N=C(NC4=O)N)C#N)OCO2
InChIInChI=1S/C14H9N5O3/c15-4-7-10-12(18-14(16)19-13(10)20)17-11(7)6-1-2-8-9(3-6)22-5-21-8/h1-3H,5H2,(H4,16,17,18,19,20)
InChIKeyLODZVZHIOMSXPI-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count31
Chiral Atom Count0
Bond Count34
Aromatic Bond Count12

Related Resource References

Resource NameReference
PubChem 25113143, 135566496
ChEMBL CHEMBL568414