2-azanyl-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one

Systemtic Name: 2-azanyl-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one Openeye Name: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one CAS Name: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]-4-pyrrolo[2,3-d]pyrimidinone IUPAC Name: 2-amino-5-[[(4-hydroxyphenyl)methylamino]methyl]pyrrolo[2,3-d]pyrimidin-4-one Traditional Name: 2-amino-5-[[(4-hydroxybenzyl)amino]methyl]pyrrolo[2,3-d]pyrimidin-4-one Formula: C14H13N5O2 MolecularWeight: 283.28532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCC2=C3C(=NC(=NC3=O)N)N=C2)O

Isomeric SMILES

C1=CC(=CC=C1CNCC2=C3C(=NC(=NC3=O)N)N=C2)O

InChI

InChI=1S/C14H13N5O2/c15-14-18-12-11(13(21)19-14)9(7-17-12)6-16-5-8-1-3-10(20)4-2-8/h1-4,7,16,20H,5-6H2,(H2,15,19,21)