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

Systemtic Name: 5-nitro-N-(phenylmethyl)-N-pyridin-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Openeye Name: N-benzyl-5-nitro-N-(2-pyridyl)-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-amine CAS Name: 5-nitro-N-(phenylmethyl)-N-(2-pyridinyl)-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-benzyl-5-nitro-N-pyridin-2-yl-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-amine Traditional Name: benzyl-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]-(2-pyridyl)amine Formula: C25H24N8O2 MolecularWeight: 468.51046

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C25H24N8O2/c34-33(35)23-24(31-16-14-30(15-17-31)21-10-4-6-12-26-21)28-19-29-25(23)32(22-11-5-7-13-27-22)18-20-8-2-1-3-9-20/h1-13,19H,14-18H2