(3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methyl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (3-bromophenyl)-[4-[2-(3-fluorophenyl)-6-methyl-pyrimidin-4-yl]piperazino]methanone Formula: C22H20BrFN4O MolecularWeight: 455.322803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)N3CCN(CC3)C(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrFN4O/c1-15-12-20(26-21(25-15)16-4-3-7-19(24)14-16)27-8-10-28(11-9-27)22(29)17-5-2-6-18(23)13-17/h2-7,12-14H,8-11H2,1H3