1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]nonan-1-one

Systemtic Name: 1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]nonan-1-one Openeye Name: 1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]nonan-1-one CAS Name: 1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperazinyl]-1-nonanone IUPAC Name: 1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]nonan-1-one Traditional Name: 1-[4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazino]nonan-1-one Formula: C27H37F3N4O MolecularWeight: 490.60409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC)C)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2CC)C)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C27H37F3N4O/c1-4-6-7-8-9-10-11-24(35)33-16-18-34(19-17-33)26-23(5-2)20(3)31-25(32-26)21-12-14-22(15-13-21)27(28,29)30/h12-15H,4-11,16-19H2,1-3H3