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

Systemtic Name: N-methyl-5-nitro-N-phenyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-methyl-5-nitro-N-phenyl-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-amine CAS Name: N-methyl-5-nitro-N-phenyl-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-methyl-5-nitro-N-phenyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: methyl-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]-phenyl-amine Formula: C20H21N7O2 MolecularWeight: 391.42644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N7O2/c1-24(16-7-3-2-4-8-16)19-18(27(28)29)20(23-15-22-19)26-13-11-25(12-14-26)17-9-5-6-10-21-17/h2-10,15H,11-14H2,1H3