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

Systemtic Name: 2-[[6-azanyl-5-nitro-2-[(phenylmethyl)amino]pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-amino-2-(benzylamino)-5-nitro-pyrimidin-4-yl]amino]ethanol CAS Name: 2-[[6-amino-5-nitro-2-[(phenylmethyl)amino]-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-amino-2-(benzylamino)-5-nitropyrimidin-4-yl]amino]ethanol Traditional Name: 2-[[6-amino-2-(benzylamino)-5-nitro-pyrimidin-4-yl]amino]ethanol Formula: C13H16N6O3 MolecularWeight: 304.30454

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC(=C(C(=N2)NCCO)[N+](=O)[O-])N

InChI

InChI=1S/C13H16N6O3/c14-11-10(19(21)22)12(15-6-7-20)18-13(17-11)16-8-9-4-2-1-3-5-9/h1-5,20H,6-8H2,(H4,14,15,16,17,18)