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

Systemtic Name: N-(4-bromophenyl)-4-[6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(4-bromophenyl)-4-[6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(4-bromophenyl)-4-[6-methyl-2-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(4-bromophenyl)-4-[6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(4-bromophenyl)-4-[6-methyl-2-[4-(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=C(C=C2)C(F)(F)F)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC(=NC(=N1)C2=CC=C(C=C2)C(F)(F)F)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)Br

InChI

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