N4-(2-methylquinolin-8-yl)-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-methylquinolin-8-yl)-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine Openeye Name: N4-(2-methyl-8-quinolyl)-5-nitro-N6-(3-pyridyl)pyrimidine-4,6-diamine CAS Name: N4-(2-methyl-8-quinolinyl)-5-nitro-N6-(3-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-(2-methylquinolin-8-yl)-5-nitro-6-N-pyridin-3-ylpyrimidine-4,6-diamine Traditional Name: (2-methyl-8-quinolyl)-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]amine Formula: C19H15N7O2 MolecularWeight: 373.3681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])NC4=CN=CC=C4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=NC=NC(=C3[N+](=O)[O-])NC4=CN=CC=C4)C=C1

InChI

InChI=1S/C19H15N7O2/c1-12-7-8-13-4-2-6-15(16(13)23-12)25-19-17(26(27)28)18(21-11-22-19)24-14-5-3-9-20-10-14/h2-11H,1H3,(H2,21,22,24,25)