1-[3-[(2-azanyl-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]-5-ethanoyl-phenyl]ethanone

Systemtic Name: 1-[3-[(2-azanyl-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]-5-ethanoyl-phenyl]ethanone Openeye Name: 1-[3-acetyl-5-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone CAS Name: 1-[3-acetyl-5-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone IUPAC Name: 1-[3-acetyl-5-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone Traditional Name: 1-[3-acetyl-5-[(2-amino-3,4-dimethyl-1,4-dihydropyrimidin-3-ium-6-yl)amino]phenyl]ethanone Formula: C16H21N4O2+ MolecularWeight: 301.36354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O2/c1-9-5-15(19-16(17)20(9)4)18-14-7-12(10(2)21)6-13(8-14)11(3)22/h5-9,18H,1-4H3,(H2,17,19)/p+1