5,6-bis(chloranyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)pyrimidin-4-amine

Systemtic Name: 5,6-bis(chloranyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)pyrimidin-4-amine Openeye Name: 5,6-dichloro-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]pyrimidin-4-amine CAS Name: 5,6-dichloro-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)-4-pyrimidinamine IUPAC Name: 5,6-dichloro-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)pyrimidin-4-amine Traditional Name: [5,6-dichloro-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]pyrimidin-4-yl]amine Formula: C14H10Cl2N5+ MolecularWeight: 319.1687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1C2=CC=[N+](C=C2)C3=NC(=C(C(=N3)Cl)Cl)N

Isomeric SMILES

C1=CN=CC=C1C2=CC=[N+](C=C2)C3=NC(=C(C(=N3)Cl)Cl)N

InChI

InChI=1S/C14H10Cl2N5/c15-11-12(16)19-14(20-13(11)17)21-7-3-10(4-8-21)9-1-5-18-6-2-9/h1-8H,(H2,17,19,20)/q+1