6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5-nitro-N2-phenyl-pyrimidine-2,4-diamine

Systemtic Name: 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5-nitro-N2-phenyl-pyrimidine-2,4-diamine Openeye Name: 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5-nitro-N2-phenyl-pyrimidine-2,4-diamine CAS Name: 6-[(2R,6R)-2,6-dimethyl-4-morpholinyl]-5-nitro-N2-phenylpyrimidine-2,4-diamine IUPAC Name: 6-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-5-nitro-2-N-phenylpyrimidine-2,4-diamine Traditional Name: [4-amino-6-[(2R,6R)-2,6-dimethylmorpholino]-5-nitro-pyrimidin-2-yl]-phenyl-amine Formula: C16H20N6O3 MolecularWeight: 344.3684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N6O3/c1-10-8-21(9-11(2)25-10)15-13(22(23)24)14(17)19-16(20-15)18-12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H3,17,18,19,20)/t10-,11-/m1/s1