5-nitro-N4-propan-2-yl-N6-quinolin-8-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4-propan-2-yl-N6-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: N4-isopropyl-5-nitro-N6-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4-propan-2-yl-N6-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N-propan-2-yl-6-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: isopropyl-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]amine Formula: C16H16N6O2 MolecularWeight: 324.33724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C16H16N6O2/c1-10(2)20-15-14(22(23)24)16(19-9-18-15)21-12-7-3-5-11-6-4-8-17-13(11)12/h3-10H,1-2H3,(H2,18,19,20,21)