N-(1-adamantyl)-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(1-adamantyl)-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine Openeye Name: N-(1-adamantyl)-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-amine CAS Name: N-(1-adamantyl)-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-4-pyrimidinamine IUPAC Name: N-(1-adamantyl)-6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitropyrimidin-4-amine Traditional Name: 1-adamantyl-[6-(3,4-dihydro-2H-quinolin-1-yl)-5-nitro-pyrimidin-4-yl]amine Formula: C23H27N5O2 MolecularWeight: 405.49278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)NC45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C3=C(C(=NC=N3)NC45CC6CC(C4)CC(C6)C5)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O2/c29-28(30)20-21(26-23-11-15-8-16(12-23)10-17(9-15)13-23)24-14-25-22(20)27-7-3-5-18-4-1-2-6-19(18)27/h1-2,4,6,14-17H,3,5,7-13H2,(H,24,25,26)