N4-(3-morpholin-4-ylpropyl)-N2-[3-(3-nitrophenyl)phenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-(3-morpholin-4-ylpropyl)-N2-[3-(3-nitrophenyl)phenyl]pyrimidine-2,4-diamine Openeye Name: N4-(3-morpholinopropyl)-N2-[3-(3-nitrophenyl)phenyl]pyrimidine-2,4-diamine CAS Name: N4-[3-(4-morpholinyl)propyl]-N2-[3-(3-nitrophenyl)phenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-morpholin-4-ylpropyl)-2-N-[3-(3-nitrophenyl)phenyl]pyrimidine-2,4-diamine Traditional Name: 3-morpholinopropyl-[2-[3-(3-nitrophenyl)anilino]pyrimidin-4-yl]amine Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCCNC2=NC(=NC=C2)NC3=CC=CC(=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H26N6O3/c30-29(31)21-7-2-5-19(17-21)18-4-1-6-20(16-18)26-23-25-10-8-22(27-23)24-9-3-11-28-12-14-32-15-13-28/h1-2,4-8,10,16-17H,3,9,11-15H2,(H2,24,25,26,27)