1-[3-(cyclohexylamino)-2-pyridin-2-yl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride

Systemtic Name: 1-[3-(cyclohexylamino)-2-pyridin-2-yl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Openeye Name: 1-[3-(cyclohexylamino)-2-(2-pyridyl)imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride CAS Name: 1-[3-(cyclohexylamino)-2-(2-pyridinyl)-1-imidazo[1,2-a]pyrimidin-4-iumyl]ethanone chloride IUPAC Name: 1-[3-(cyclohexylamino)-2-pyridin-2-ylimidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Traditional Name: 1-[3-(cyclohexylamino)-2-(2-pyridyl)imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Formula: C19H22ClN5O MolecularWeight: 371.86388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=C([N+]2=CC=CN=C12)NC3CCCCC3)C4=CC=CC=N4.[Cl-]

Isomeric SMILES

CC(=O)N1C(=C([N+]2=CC=CN=C12)NC3CCCCC3)C4=CC=CC=N4.[Cl-]

InChI

InChI=1S/C19H22N5O.ClH/c1-14(25)24-17(16-10-5-6-11-20-16)18(22-15-8-3-2-4-9-15)23-13-7-12-21-19(23)24;/h5-7,10-13,15,22H,2-4,8-9H2,1H3;1H/q+1;/p-1