6-ethoxy-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-ethoxy-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-ethoxy-N-(3-imidazol-1-ylpropyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-ethoxy-N-[3-(1-imidazolyl)propyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-ethoxy-N-(3-imidazol-1-ylpropyl)-5-nitropyrimidin-4-amine Traditional Name: (6-ethoxy-5-nitro-pyrimidin-4-yl)-(3-imidazol-1-ylpropyl)amine Formula: C12H16N6O3 MolecularWeight: 292.29384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

CCOC1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C12H16N6O3/c1-2-21-12-10(18(19)20)11(15-8-16-12)14-4-3-6-17-7-5-13-9-17/h5,7-9H,2-4,6H2,1H3,(H,14,15,16)