N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(2-bromophenyl)-4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazine-1-carboxamide Formula: C25H25BrF3N5O MolecularWeight: 548.39811

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)NC3=CC=CC=C3Br)C4=CC(=CC=C4)C(F)(F)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)NC3=CC=CC=C3Br)C4=CC(=CC=C4)C(F)(F)F)C

InChI

InChI=1S/C25H25BrF3N5O/c1-3-19-16(2)30-22(17-7-6-8-18(15-17)25(27,28)29)32-23(19)33-11-13-34(14-12-33)24(35)31-21-10-5-4-9-20(21)26/h4-10,15H,3,11-14H2,1-2H3,(H,31,35)