N4-[(2-chlorophenyl)methyl]-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[(2-chlorophenyl)methyl]-N6-(3-morpholin-4-ylpropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-[(2-chlorophenyl)methyl]-N6-(3-morpholinopropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-[(2-chlorophenyl)methyl]-N6-[3-(4-morpholinyl)propyl]-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-[(2-chlorophenyl)methyl]-6-N-(3-morpholin-4-ylpropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: (2-chlorobenzyl)-[6-(3-morpholinopropylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C18H23ClN6O3 MolecularWeight: 406.86662

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3Cl

Isomeric SMILES

C1COCCN1CCCNC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3Cl

InChI

InChI=1S/C18H23ClN6O3/c19-15-5-2-1-4-14(15)12-21-18-16(25(26)27)17(22-13-23-18)20-6-3-7-24-8-10-28-11-9-24/h1-2,4-5,13H,3,6-12H2,(H2,20,21,22,23)