5-chloranyl-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride

Systemtic Name: 5-chloranyl-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride Openeye Name: 5-chloro-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride CAS Name: 5-chloro-2,6-bis(1-pyridin-1-iumyl)-4-pyrimidinamine dichloride IUPAC Name: 5-chloro-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride Traditional Name: [5-chloro-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-yl]amine dichloride Formula: C14H12Cl3N5 MolecularWeight: 356.63758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C2=C(C(=NC(=N2)[N+]3=CC=CC=C3)N)Cl.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C2=C(C(=NC(=N2)[N+]3=CC=CC=C3)N)Cl.[Cl-].[Cl-]

InChI

InChI=1S/C14H12ClN5.2ClH/c15-11-12(16)17-14(20-9-5-2-6-10-20)18-13(11)19-7-3-1-4-8-19;;/h1-10H,(H2,16,17,18);2*1H/q+2;;/p-2