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

Systemtic Name: N-(4-chlorophenyl)-5-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine Openeye Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-2-amine CAS Name: N-(4-chlorophenyl)-5-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]-2-pyrimidinamine IUPAC Name: N-(4-chlorophenyl)-5-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-2-amine Traditional Name: (4-chlorophenyl)-[5-nitro-4-[4-(2-pyridyl)piperazino]pyrimidin-2-yl]amine Formula: C19H18ClN7O2 MolecularWeight: 411.84492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=NC(=NC=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=NC(=NC=C3[N+](=O)[O-])NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H18ClN7O2/c20-14-4-6-15(7-5-14)23-19-22-13-16(27(28)29)18(24-19)26-11-9-25(10-12-26)17-3-1-2-8-21-17/h1-8,13H,9-12H2,(H,22,23,24)