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

Systemtic Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Openeye Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide CAS Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]-4-pyrimidinyl]-N-(3-ethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Traditional Name: 4-[5-ethyl-6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Formula: C27H30F3N5O MolecularWeight: 497.55521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC)C)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC)C)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C27H30F3N5O/c1-4-19-7-6-8-22(17-19)32-26(36)35-15-13-34(14-16-35)25-23(5-2)18(3)31-24(33-25)20-9-11-21(12-10-20)27(28,29)30/h6-12,17H,4-5,13-16H2,1-3H3,(H,32,36)