N4-methyl-N6-(3-morpholin-4-ylpropyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine

Systemtic Name: N4-methyl-N6-(3-morpholin-4-ylpropyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine Openeye Name: N4-methyl-N6-(3-morpholinopropyl)-5-nitro-N4-phenyl-pyrimidine-4,6-diamine CAS Name: N4-methyl-N6-[3-(4-morpholinyl)propyl]-5-nitro-N4-phenylpyrimidine-4,6-diamine IUPAC Name: 4-N-methyl-6-N-(3-morpholin-4-ylpropyl)-5-nitro-4-N-phenylpyrimidine-4,6-diamine Traditional Name: methyl-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]-phenyl-amine Formula: C18H24N6O3 MolecularWeight: 372.42156

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCCCN3CCOCC3

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])NCCCN3CCOCC3

InChI

InChI=1S/C18H24N6O3/c1-22(15-6-3-2-4-7-15)18-16(24(25)26)17(20-14-21-18)19-8-5-9-23-10-12-27-13-11-23/h2-4,6-7,14H,5,8-13H2,1H3,(H,19,20,21)