1-[4-[(2-azanyl-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide

Systemtic Name: 1-[4-[(2-azanyl-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide Openeye Name: 1-[4-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide CAS Name: 1-[4-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide IUPAC Name: 1-[4-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide Traditional Name: 1-[4-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone iodide Formula: C14H19IN4O MolecularWeight: 386.23133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C=C(NC(=[N+]1C)N)NC2=CC=C(C=C2)C(=O)C.[I-]

Isomeric SMILES

CC1C=C(NC(=[N+]1C)N)NC2=CC=C(C=C2)C(=O)C.[I-]

InChI

InChI=1S/C14H18N4O.HI/c1-9-8-13(17-14(15)18(9)3)16-12-6-4-11(5-7-12)10(2)19;/h4-9H,1-3H3,(H3,15,16,17,19);1H