N-(3-imidazol-1-ylpropyl)-5-nitro-6-propan-2-yloxy-pyrimidin-4-amine

Systemtic Name: N-(3-imidazol-1-ylpropyl)-5-nitro-6-propan-2-yloxy-pyrimidin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-6-isopropoxy-5-nitro-pyrimidin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-5-nitro-6-propan-2-yloxy-4-pyrimidinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-5-nitro-6-propan-2-yloxypyrimidin-4-amine Traditional Name: 3-imidazol-1-ylpropyl-(6-isopropoxy-5-nitro-pyrimidin-4-yl)amine Formula: C13H18N6O3 MolecularWeight: 306.32042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])NCCCN2C=CN=C2

InChI

InChI=1S/C13H18N6O3/c1-10(2)22-13-11(19(20)21)12(16-8-17-13)15-4-3-6-18-7-5-14-9-18/h5,7-10H,3-4,6H2,1-2H3,(H,15,16,17)