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

Systemtic Name: N-ethyl-5-nitro-N-phenyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-ethyl-5-nitro-N-phenyl-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-amine CAS Name: N-ethyl-5-nitro-N-phenyl-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-ethyl-5-nitro-N-phenyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: ethyl-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]-phenyl-amine Formula: C21H23N7O2 MolecularWeight: 405.45302

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=NC=NC(=C2[N+](=O)[O-])N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C21H23N7O2/c1-2-27(17-8-4-3-5-9-17)21-19(28(29)30)20(23-16-24-21)26-14-12-25(13-15-26)18-10-6-7-11-22-18/h3-11,16H,2,12-15H2,1H3