N4-(2-methylquinolin-5-yl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-methylquinolin-5-yl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine Openeye Name: N4-(2-methyl-5-quinolyl)-5-nitro-N6-propyl-pyrimidine-4,6-diamine CAS Name: N4-(2-methyl-5-quinolinyl)-5-nitro-N6-propylpyrimidine-4,6-diamine IUPAC Name: 4-N-(2-methylquinolin-5-yl)-5-nitro-6-N-propylpyrimidine-4,6-diamine Traditional Name: (2-methyl-5-quinolyl)-[5-nitro-6-(propylamino)pyrimidin-4-yl]amine Formula: C17H18N6O2 MolecularWeight: 338.36382

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2C=CC(=N3)C

Isomeric SMILES

CCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2C=CC(=N3)C

InChI

InChI=1S/C17H18N6O2/c1-3-9-18-16-15(23(24)25)17(20-10-19-16)22-14-6-4-5-13-12(14)8-7-11(2)21-13/h4-8,10H,3,9H2,1-2H3,(H2,18,19,20,22)