2-[4-azanylidene-5-(ethoxymethyl)-2-methyl-pyrimidin-1-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[4-azanylidene-5-(ethoxymethyl)-2-methyl-pyrimidin-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[5-(ethoxymethyl)-4-imino-2-methyl-pyrimidin-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[5-(ethoxymethyl)-4-imino-2-methyl-1-pyrimidinyl]-1-phenylethanone bromide IUPAC Name: 2-[5-(ethoxymethyl)-4-imino-2-methylpyrimidin-1-yl]-1-phenylethanone bromide Traditional Name: 2-[5-(ethoxymethyl)-4-imino-2-methyl-pyrimidin-1-yl]-1-phenyl-ethanone bromide Formula: C16H19BrN3O2- MolecularWeight: 365.24496

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=CN(C(=NC1=N)C)CC(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

CCOCC1=CN(C(=NC1=N)C)CC(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C16H19N3O2.BrH/c1-3-21-11-14-9-19(12(2)18-16(14)17)10-15(20)13-7-5-4-6-8-13;/h4-9,17H,3,10-11H2,1-2H3;1H/p-1