4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine CAS Name: 4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-[4-(2-pyrimidinyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 4-[4-(4-chlorophenyl)-3,6-dihydro-2H-pyridin-1-yl]-5-nitro-6-[4-(2-pyrimidyl)piperazino]pyrimidine Formula: C23H23ClN8O2 MolecularWeight: 478.93412

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC=C1C2=CC=C(C=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C5=NC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC=C1C2=CC=C(C=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C5=NC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C23H23ClN8O2/c24-19-4-2-17(3-5-19)18-6-10-29(11-7-18)21-20(32(33)34)22(28-16-27-21)30-12-14-31(15-13-30)23-25-8-1-9-26-23/h1-6,8-9,16H,7,10-15H2