5-nitro-N-propan-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine

Systemtic Name: 5-nitro-N-propan-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-isopropyl-5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-amine CAS Name: 5-nitro-N-propan-2-yl-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: 5-nitro-N-propan-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: isopropyl-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]amine Formula: C16H21N7O2 MolecularWeight: 343.38364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

CC(C)NC1=NC=NC(=C1[N+](=O)[O-])N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C16H21N7O2/c1-12(2)20-15-14(23(24)25)16(19-11-18-15)22-9-7-21(8-10-22)13-5-3-4-6-17-13/h3-6,11-12H,7-10H2,1-2H3,(H,18,19,20)