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

Systemtic Name: 5-chloranyl-N-phenyl-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride Openeye Name: 5-chloro-N-phenyl-2,6-di(pyridin-1-ium-1-yl)pyrimidin-4-amine dichloride CAS Name: 5-chloro-N-phenyl-2,6-bis(1-pyridin-1-iumyl)-4-pyrimidinamine dichloride IUPAC Name: 5-chloro-N-phenyl-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]-phenyl-amine dichloride Formula: C20H16Cl3N5 MolecularWeight: 432.73354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=C2Cl)[N+]3=CC=CC=C3)[N+]4=CC=CC=C4.[Cl-].[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=C2Cl)[N+]3=CC=CC=C3)[N+]4=CC=CC=C4.[Cl-].[Cl-]

InChI

InChI=1S/C20H16ClN5.2ClH/c21-17-18(22-16-10-4-1-5-11-16)23-20(26-14-8-3-9-15-26)24-19(17)25-12-6-2-7-13-25;;/h1-15H,(H,22,23,24);2*1H/q+2;;/p-2