2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(3-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-N4-(m-tolyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: 2-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-N4-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-4-N-(3-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-amino-2-[(2S,6S)-2,6-dimethylmorpholino]-5-nitro-pyrimidin-4-yl]-(m-tolyl)amine Formula: C17H22N6O3 MolecularWeight: 358.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C2=NC(=C(C(=N2)NC3=CC=CC(=C3)C)[N+](=O)[O-])N

Isomeric SMILES

C[C@H]1CN(C[C@@H](O1)C)C2=NC(=C(C(=N2)NC3=CC=CC(=C3)C)[N+](=O)[O-])N

InChI

InChI=1S/C17H22N6O3/c1-10-5-4-6-13(7-10)19-16-14(23(24)25)15(18)20-17(21-16)22-8-11(2)26-12(3)9-22/h4-7,11-12H,8-9H2,1-3H3,(H3,18,19,20,21)/t11-,12-/m0/s1