4-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine

Systemtic Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Openeye Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidine CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-6-[4-(2-pyridinyl)-1-piperazinyl]pyrimidine IUPAC Name: 4-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidine Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidine Formula: C23H25ClN8O2 MolecularWeight: 480.95

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)N4CCN(CC4)C5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C23H25ClN8O2/c24-18-4-3-5-19(16-18)28-8-12-30(13-9-28)22-21(32(33)34)23(27-17-26-22)31-14-10-29(11-15-31)20-6-1-2-7-25-20/h1-7,16-17H,8-15H2