1-[6-azanyl-2-(4-chlorophenyl)-4-methyl-pyrimidin-1-ium-5-yl]ethanone

Systemtic Name: 1-[6-azanyl-2-(4-chlorophenyl)-4-methyl-pyrimidin-1-ium-5-yl]ethanone Openeye Name: 1-[6-amino-2-(4-chlorophenyl)-4-methyl-pyrimidin-1-ium-5-yl]ethanone CAS Name: 1-[6-amino-2-(4-chlorophenyl)-4-methyl-5-pyrimidin-1-iumyl]ethanone IUPAC Name: 1-[6-amino-2-(4-chlorophenyl)-4-methylpyrimidin-1-ium-5-yl]ethanone Traditional Name: 1-[6-amino-2-(4-chlorophenyl)-4-methyl-pyrimidin-1-ium-5-yl]ethanone Formula: C13H13ClN3O+ MolecularWeight: 262.71482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[NH+]C(=N1)C2=CC=C(C=C2)Cl)N)C(=O)C

Isomeric SMILES

CC1=C(C(=[NH+]C(=N1)C2=CC=C(C=C2)Cl)N)C(=O)C

InChI

InChI=1S/C13H12ClN3O/c1-7-11(8(2)18)12(15)17-13(16-7)9-3-5-10(14)6-4-9/h3-6H,1-2H3,(H2,15,16,17)/p+1