1-[5-azanyl-7-chloranyl-3-(cyclohexylamino)-2-pyridin-2-yl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone

Systemtic Name: 1-[5-azanyl-7-chloranyl-3-(cyclohexylamino)-2-pyridin-2-yl-imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone Openeye Name: 1-[5-amino-7-chloro-3-(cyclohexylamino)-2-(2-pyridyl)imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone CAS Name: 1-[5-amino-7-chloro-3-(cyclohexylamino)-2-(2-pyridinyl)-1-imidazo[1,2-a]pyrimidin-4-iumyl]ethanone IUPAC Name: 1-[5-amino-7-chloro-3-(cyclohexylamino)-2-pyridin-2-ylimidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone Traditional Name: 1-[5-amino-7-chloro-3-(cyclohexylamino)-2-(2-pyridyl)imidazo[1,2-a]pyrimidin-4-ium-1-yl]ethanone Formula: C19H22ClN6O+ MolecularWeight: 385.87058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN6O/c1-12(27)25-17(14-9-5-6-10-22-14)18(23-13-7-3-2-4-8-13)26-16(21)11-15(20)24-19(25)26/h5-6,9-11,13,21H,2-4,7-8H2,1H3,(H,22,23)/p+1