6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(4-phenyldiazenylphenyl)pyrimidin-4-amine

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(4-phenyldiazenylphenyl)pyrimidin-4-amine Openeye Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(4-phenylazophenyl)pyrimidin-4-amine CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-N-(4-phenyldiazenylphenyl)-4-pyrimidinamine IUPAC Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-N-(4-phenyldiazenylphenyl)pyrimidin-4-amine Traditional Name: [6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]-(4-phenylazophenyl)amine Formula: C26H23ClN8O2 MolecularWeight: 514.96622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=CC=C(C=C4)N=NC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC(=CC=C2)Cl)C3=C(C(=NC=N3)NC4=CC=C(C=C4)N=NC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H23ClN8O2/c27-19-5-4-8-23(17-19)33-13-15-34(16-14-33)26-24(35(36)37)25(28-18-29-26)30-20-9-11-22(12-10-20)32-31-21-6-2-1-3-7-21/h1-12,17-18H,13-16H2,(H,28,29,30)