N'-methyl-N-(6-morpholin-4-yl-5-nitro-pyrimidin-4-yl)-N'-phenyl-propane-1,3-diamine

Systemtic Name: N'-methyl-N-(6-morpholin-4-yl-5-nitro-pyrimidin-4-yl)-N'-phenyl-propane-1,3-diamine Openeye Name: N'-methyl-N-(6-morpholino-5-nitro-pyrimidin-4-yl)-N'-phenyl-propane-1,3-diamine CAS Name: N'-methyl-N-[6-(4-morpholinyl)-5-nitro-4-pyrimidinyl]-N'-phenylpropane-1,3-diamine IUPAC Name: N'-methyl-N-(6-morpholin-4-yl-5-nitropyrimidin-4-yl)-N'-phenylpropane-1,3-diamine Traditional Name: methyl-[3-[(6-morpholino-5-nitro-pyrimidin-4-yl)amino]propyl]-phenyl-amine Formula: C18H24N6O3 MolecularWeight: 372.42156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC1=NC=NC(=C1[N+](=O)[O-])N2CCOCC2)C3=CC=CC=C3

InChI

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