2-(2-bromanyl-4-methyl-phenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2-bromanyl-4-methyl-phenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone Openeye Name: 2-(2-bromo-4-methyl-phenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethanone CAS Name: 2-(2-bromo-4-methylphenoxy)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(2-bromo-4-methylphenoxy)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanone Traditional Name: 2-(2-bromo-4-methyl-phenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]ethanone Formula: C21H27BrN4O2 MolecularWeight: 447.36868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27BrN4O2/c1-14(2)21-23-16(4)12-19(24-21)25-7-9-26(10-8-25)20(27)13-28-18-6-5-15(3)11-17(18)22/h5-6,11-12,14H,7-10,13H2,1-4H3