N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-pyrimidin-4-yl)piperazine-1-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazine-1-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(6-methyl-2-phenyl-5-propan-2-ylpyrimidin-4-yl)piperazine-1-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-4-(5-isopropyl-6-methyl-2-phenyl-pyrimidin-4-yl)piperazine-1-carboxamide Formula: C27H27F6N5O MolecularWeight: 551.526599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H27F6N5O/c1-16(2)22-17(3)34-23(18-7-5-4-6-8-18)36-24(22)37-9-11-38(12-10-37)25(39)35-21-14-19(26(28,29)30)13-20(15-21)27(31,32)33/h4-8,13-16H,9-12H2,1-3H3,(H,35,39)