2-[[6-azanyl-5-nitro-2-(phenethylamino)pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[[6-azanyl-5-nitro-2-(phenethylamino)pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-amino-5-nitro-2-(phenethylamino)pyrimidin-4-yl]amino]ethanol CAS Name: 2-[[6-amino-5-nitro-2-(phenethylamino)-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-amino-5-nitro-2-(phenethylamino)pyrimidin-4-yl]amino]ethanol Traditional Name: 2-[[6-amino-5-nitro-2-(phenethylamino)pyrimidin-4-yl]amino]ethanol Formula: C14H18N6O3 MolecularWeight: 318.33112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N

InChI

InChI=1S/C14H18N6O3/c15-12-11(20(22)23)13(16-8-9-21)19-14(18-12)17-7-6-10-4-2-1-3-5-10/h1-5,21H,6-9H2,(H4,15,16,17,18,19)