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

Systemtic Name: 1-[3-(cyclohexylamino)-2-phenyl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Openeye Name: 1-[3-(cyclohexylamino)-2-phenyl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride CAS Name: 1-[3-(cyclohexylamino)-2-phenyl-1-imidazo[1,2-a]pyrimidin-4-iumyl]ethanone chloride IUPAC Name: 1-[3-(cyclohexylamino)-2-phenylimidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Traditional Name: 1-[3-(cyclohexylamino)-2-phenyl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone chloride Formula: C20H23ClN4O MolecularWeight: 370.87582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N4O.ClH/c1-15(25)24-18(16-9-4-2-5-10-16)19(22-17-11-6-3-7-12-17)23-14-8-13-21-20(23)24;/h2,4-5,8-10,13-14,17,22H,3,6-7,11-12H2,1H3;1H/q+1;/p-1