[4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]-naphthalen-2-yl-methanone

Systemtic Name: [4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]-naphthalen-2-yl-methanone Openeye Name: [4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]-(2-naphthyl)methanone CAS Name: [4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]-4-pyrimidinyl]-1-piperazinyl]-(2-naphthalenyl)methanone IUPAC Name: [4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazin-1-yl]-naphthalen-2-ylmethanone Traditional Name: [4-[5-ethyl-6-methyl-2-[3-(trifluoromethyl)phenyl]pyrimidin-4-yl]piperazino]-(2-naphthyl)methanone Formula: C29H27F3N4O MolecularWeight: 504.54609

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)C(F)(F)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3)C5=CC(=CC=C5)C(F)(F)F)C

InChI

InChI=1S/C29H27F3N4O/c1-3-25-19(2)33-26(22-9-6-10-24(18-22)29(30,31)32)34-27(25)35-13-15-36(16-14-35)28(37)23-12-11-20-7-4-5-8-21(20)17-23/h4-12,17-18H,3,13-16H2,1-2H3