2-[ethyl-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]ethanol

Systemtic Name: 2-[ethyl-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]ethanol Openeye Name: 2-[ethyl-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]amino]ethanol CAS Name: 2-[ethyl-[5-nitro-6-(3-pyridinylmethylamino)-4-pyrimidinyl]amino]ethanol IUPAC Name: 2-[ethyl-[5-nitro-6-(pyridin-3-ylmethylamino)pyrimidin-4-yl]amino]ethanol Traditional Name: 2-[ethyl-[5-nitro-6-(3-pyridylmethylamino)pyrimidin-4-yl]amino]ethanol Formula: C14H18N6O3 MolecularWeight: 318.33112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N6O3/c1-2-19(6-7-21)14-12(20(22)23)13(17-10-18-14)16-9-11-4-3-5-15-8-11/h3-5,8,10,21H,2,6-7,9H2,1H3,(H,16,17,18)