6-chloranyl-N4-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrimidine-2,4-diamine

Systemtic Name: 6-chloranyl-N4-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrimidine-2,4-diamine Openeye Name: 6-chloro-N4-[4-(1,3-dimethylimidazol-1-ium-2-yl)azophenyl]pyrimidine-2,4-diamine CAS Name: 6-chloro-N4-[4-[(1,3-dimethyl-2-imidazol-1-iumyl)azo]phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-4-N-[4-[(1,3-dimethylimidazol-1-ium-2-yl)diazenyl]phenyl]pyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-[4-(1,3-dimethylimidazol-1-ium-2-yl)azophenyl]amine Formula: C15H16ClN8+ MolecularWeight: 343.79414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NC3=CC(=NC(=N3)N)Cl)C

Isomeric SMILES

CN1C=C[N+](=C1N=NC2=CC=C(C=C2)NC3=CC(=NC(=N3)N)Cl)C

InChI

InChI=1S/C15H15ClN8/c1-23-7-8-24(2)15(23)22-21-11-5-3-10(4-6-11)18-13-9-12(16)19-14(17)20-13/h3-9H,1-2H3,(H2,17,19,20)/p+1