2-[[6-azanyl-2-[3-(diethylamino)propylamino]-5-nitro-pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[[6-azanyl-2-[3-(diethylamino)propylamino]-5-nitro-pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-amino-2-[3-(diethylamino)propylamino]-5-nitro-pyrimidin-4-yl]amino]ethanol CAS Name: 2-[[6-amino-2-[3-(diethylamino)propylamino]-5-nitro-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-amino-2-[3-(diethylamino)propylamino]-5-nitropyrimidin-4-yl]amino]ethanol Traditional Name: 2-[[6-amino-2-[3-(diethylamino)propylamino]-5-nitro-pyrimidin-4-yl]amino]ethanol Formula: C13H25N7O3 MolecularWeight: 327.3827

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC1=NC(=C(C(=N1)NCCO)[N+](=O)[O-])N

Isomeric SMILES

CCN(CC)CCCNC1=NC(=C(C(=N1)NCCO)[N+](=O)[O-])N

InChI

InChI=1S/C13H25N7O3/c1-3-19(4-2)8-5-6-16-13-17-11(14)10(20(22)23)12(18-13)15-7-9-21/h21H,3-9H2,1-2H3,(H4,14,15,16,17,18)