N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-[6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Formula: C23H21BrF3N5O MolecularWeight: 520.34495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C2=CC(=CC=C2)C(F)(F)F)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC(=CC=C2)C(F)(F)F)N3CCN(CC3)C(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C23H21BrF3N5O/c1-15-13-20(30-21(28-15)16-5-4-6-17(14-16)23(25,26)27)31-9-11-32(12-10-31)22(33)29-19-8-3-2-7-18(19)24/h2-8,13-14H,9-12H2,1H3,(H,29,33)