4-imidazol-1-yl-6-methyl-N-[(3R,4S)-4-methyloxolan-3-yl]-5-nitro-pyrimidin-2-amine

Systemtic Name: 4-imidazol-1-yl-6-methyl-N-[(3R,4S)-4-methyloxolan-3-yl]-5-nitro-pyrimidin-2-amine Openeye Name: 4-imidazol-1-yl-6-methyl-N-[(3R,4S)-4-methyltetrahydrofuran-3-yl]-5-nitro-pyrimidin-2-amine CAS Name: 4-(1-imidazolyl)-6-methyl-N-[(3R,4S)-4-methyl-3-oxolanyl]-5-nitro-2-pyrimidinamine IUPAC Name: 4-imidazol-1-yl-6-methyl-N-[(3R,4S)-4-methyloxolan-3-yl]-5-nitropyrimidin-2-amine Traditional Name: (4-imidazol-1-yl-6-methyl-5-nitro-pyrimidin-2-yl)-[(3R,4S)-4-methyltetrahydrofuran-3-yl]amine Formula: C13H16N6O3 MolecularWeight: 304.30454

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Descriptors Computed from Structure

Canonical SMILES:

CC1COCC1NC2=NC(=C(C(=N2)N3C=CN=C3)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1COC[C@@H]1NC2=NC(=C(C(=N2)N3C=CN=C3)[N+](=O)[O-])C

InChI

InChI=1S/C13H16N6O3/c1-8-5-22-6-10(8)16-13-15-9(2)11(19(20)21)12(17-13)18-4-3-14-7-18/h3-4,7-8,10H,5-6H2,1-2H3,(H,15,16,17)/t8-,10+/m1/s1