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

Systemtic Name: 2-[ethyl-[5-nitro-6-[(phenylmethyl)amino]pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[[6-(benzylamino)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol CAS Name: 2-[ethyl-[5-nitro-6-[(phenylmethyl)amino]-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[[6-(benzylamino)-5-nitropyrimidin-4-yl]-ethylamino]ethanol Traditional Name: 2-[[6-(benzylamino)-5-nitro-pyrimidin-4-yl]-ethyl-amino]ethanol Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CC=C2

Isomeric SMILES

CCN(CCO)C1=NC=NC(=C1[N+](=O)[O-])NCC2=CC=CC=C2

InChI

InChI=1S/C15H19N5O3/c1-2-19(8-9-21)15-13(20(22)23)14(17-11-18-15)16-10-12-6-4-3-5-7-12/h3-7,11,21H,2,8-10H2,1H3,(H,16,17,18)