2-[4-[5-azanyl-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol

Systemtic Name: 2-[4-[5-azanyl-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Openeye Name: 2-[4-[5-amino-6-(3-pyridylmethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol CAS Name: 2-[4-[5-amino-6-(3-pyridinylmethylamino)-4-pyrimidinyl]-1-piperazinyl]ethanol IUPAC Name: 2-[4-[5-amino-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]piperazin-1-yl]ethanol Traditional Name: 2-[4-[5-amino-6-(3-pyridylmethylamino)pyrimidin-4-yl]piperazino]ethanol Formula: C16H23N7O MolecularWeight: 329.40012

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C2=C(C(=NC=N2)NCC3=CN=CC=C3)N

Isomeric SMILES

C1CN(CCN1CCO)C2=C(C(=NC=N2)NCC3=CN=CC=C3)N

InChI

InChI=1S/C16H23N7O/c17-14-15(19-11-13-2-1-3-18-10-13)20-12-21-16(14)23-6-4-22(5-7-23)8-9-24/h1-3,10,12,24H,4-9,11,17H2,(H,19,20,21)