2-(3-bromanylphenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3-bromanylphenoxy)-1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]ethanone Openeye Name: 2-(3-bromophenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]ethanone CAS Name: 2-(3-bromophenoxy)-1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3-bromophenoxy)-1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]ethanone Traditional Name: 2-(3-bromophenoxy)-1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]ethanone Formula: C20H25BrN4O2 MolecularWeight: 433.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=CC(=CC=C3)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)COC3=CC(=CC=C3)Br

InChI

InChI=1S/C20H25BrN4O2/c1-14(2)20-22-15(3)11-18(23-20)24-7-9-25(10-8-24)19(26)13-27-17-6-4-5-16(21)12-17/h4-6,11-12,14H,7-10,13H2,1-3H3