N6-(3-morpholin-4-ylpropyl)-5-nitro-N4-pyridin-2-yl-pyrimidine-4,6-diamine

Systemtic Name: N6-(3-morpholin-4-ylpropyl)-5-nitro-N4-pyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N6-(3-morpholinopropyl)-5-nitro-N4-(2-pyridyl)pyrimidine-4,6-diamine CAS Name: N6-[3-(4-morpholinyl)propyl]-5-nitro-N4-(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(3-morpholin-4-ylpropyl)-5-nitro-4-N-pyridin-2-ylpyrimidine-4,6-diamine Traditional Name: 3-morpholinopropyl-[5-nitro-6-(2-pyridylamino)pyrimidin-4-yl]amine Formula: C16H21N7O3 MolecularWeight: 359.38304

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=N3

Isomeric SMILES

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC=N3

InChI

InChI=1S/C16H21N7O3/c24-23(25)14-15(18-6-3-7-22-8-10-26-11-9-22)19-12-20-16(14)21-13-4-1-2-5-17-13/h1-2,4-5,12H,3,6-11H2,(H2,17,18,19,20,21)