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

Systemtic Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-naphthalen-1-yl-piperazine-1-carboxamide Openeye Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(1-naphthyl)piperazine-1-carboxamide CAS Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-N-(1-naphthalenyl)-1-piperazinecarboxamide IUPAC Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-naphthalen-1-ylpiperazine-1-carboxamide Traditional Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(1-naphthyl)piperazine-1-carboxamide Formula: C29H28F3N5O MolecularWeight: 519.56073

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)NC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)C(F)(F)F)C

Isomeric SMILES

CCC1=C(N=C(N=C1N2CCN(CC2)C(=O)NC3=CC=CC4=CC=CC=C43)C5=CC=C(C=C5)C(F)(F)F)C

InChI

InChI=1S/C29H28F3N5O/c1-3-23-19(2)33-26(21-11-13-22(14-12-21)29(30,31)32)35-27(23)36-15-17-37(18-16-36)28(38)34-25-10-6-8-20-7-4-5-9-24(20)25/h4-14H,3,15-18H2,1-2H3,(H,34,38)