1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone

Systemtic Name: 1-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone Openeye Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone CAS Name: 1-[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-2-(2,6-dimethylphenoxy)ethanone IUPAC Name: 1-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-2-(2,6-dimethylphenoxy)ethanone Traditional Name: 1-[4-(5-bromopyrimidin-2-yl)piperazino]-2-(2,6-dimethylphenoxy)ethanone Formula: C18H21BrN4O2 MolecularWeight: 405.28894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC(=O)N2CCN(CC2)C3=NC=C(C=N3)Br

InChI

InChI=1S/C18H21BrN4O2/c1-13-4-3-5-14(2)17(13)25-12-16(24)22-6-8-23(9-7-22)18-20-10-15(19)11-21-18/h3-5,10-11H,6-9,12H2,1-2H3