4-imidazol-1-yl-N,6-dimethyl-5-nitro-N-(phenylmethyl)pyrimidin-2-amine

Systemtic Name: 4-imidazol-1-yl-N,6-dimethyl-5-nitro-N-(phenylmethyl)pyrimidin-2-amine Openeye Name: N-benzyl-4-imidazol-1-yl-N,6-dimethyl-5-nitro-pyrimidin-2-amine CAS Name: 4-(1-imidazolyl)-N,6-dimethyl-5-nitro-N-(phenylmethyl)-2-pyrimidinamine IUPAC Name: N-benzyl-4-imidazol-1-yl-N,6-dimethyl-5-nitropyrimidin-2-amine Traditional Name: benzyl-(4-imidazol-1-yl-6-methyl-5-nitro-pyrimidin-2-yl)-methyl-amine Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N(C)CC2=CC=CC=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NC(=N1)N(C)CC2=CC=CC=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O2/c1-12-14(22(23)24)15(21-9-8-17-11-21)19-16(18-12)20(2)10-13-6-4-3-5-7-13/h3-9,11H,10H2,1-2H3