[2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [2-cyano-4-(2,2-dimethylpropylamino)-5-pyrimidinyl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [2-cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [2-cyano-4-(neopentylamino)pyrimidin-5-yl]methyl-[2-(4-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C22H32N5O+ MolecularWeight: 382.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC1=NC(=NC=C1C[N+](C)(C)CCC2=CC=C(C=C2)OC)C#N

Isomeric SMILES

CC(C)(C)CNC1=NC(=NC=C1C[N+](C)(C)CCC2=CC=C(C=C2)OC)C#N

InChI

InChI=1S/C22H32N5O/c1-22(2,3)16-25-21-18(14-24-20(13-23)26-21)15-27(4,5)12-11-17-7-9-19(28-6)10-8-17/h7-10,14H,11-12,15-16H2,1-6H3,(H,24,25,26)/q+1