(7-bromanyl-1-benzofuran-2-yl)-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (7-bromanyl-1-benzofuran-2-yl)-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (7-bromobenzofuran-2-yl)-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (7-bromo-2-benzofuranyl)-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (7-bromo-1-benzofuran-2-yl)-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (7-bromobenzofuran-2-yl)-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]methanone Formula: C21H23BrN4O2 MolecularWeight: 443.33692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=CC4=C(O3)C(=CC=C4)Br

InChI

InChI=1S/C21H23BrN4O2/c1-13(2)20-23-14(3)11-18(24-20)25-7-9-26(10-8-25)21(27)17-12-15-5-4-6-16(22)19(15)28-17/h4-6,11-13H,7-10H2,1-3H3