4-imidazol-1-yl-6-methyl-2-[(2S)-2-methylpiperidin-1-yl]-5-nitro-pyrimidine

Systemtic Name: 4-imidazol-1-yl-6-methyl-2-[(2S)-2-methylpiperidin-1-yl]-5-nitro-pyrimidine Openeye Name: 4-imidazol-1-yl-6-methyl-2-[(2S)-2-methyl-1-piperidyl]-5-nitro-pyrimidine CAS Name: 4-(1-imidazolyl)-6-methyl-2-[(2S)-2-methyl-1-piperidinyl]-5-nitropyrimidine IUPAC Name: 4-imidazol-1-yl-6-methyl-2-[(2S)-2-methylpiperidin-1-yl]-5-nitropyrimidine Traditional Name: 4-imidazol-1-yl-6-methyl-2-[(2S)-2-methylpiperidino]-5-nitro-pyrimidine Formula: C14H18N6O2 MolecularWeight: 302.33172

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NC(=C(C(=N2)N3C=CN=C3)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1CCCCN1C2=NC(=C(C(=N2)N3C=CN=C3)[N+](=O)[O-])C

InChI

InChI=1S/C14H18N6O2/c1-10-5-3-4-7-19(10)14-16-11(2)12(20(21)22)13(17-14)18-8-6-15-9-18/h6,8-10H,3-5,7H2,1-2H3/t10-/m0/s1