(E)-N-[(2S)-1-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-N-[(4-pyridin-2-ylphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-[(2S)-1-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-1-oxidanylidene-3-phenyl-propan-2-yl]-N-[(4-pyridin-2-ylphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-[(1S)-1-benzyl-2-oxo-2-[4-(p-tolylmethyl)piperazin-1-yl]ethyl]-N-[[4-(2-pyridyl)phenyl]methyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-N-[(2S)-1-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-1-oxo-3-phenylpropan-2-yl]-N-[[4-(2-pyridinyl)phenyl]methyl]-3-[4-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[(2S)-1-[4-[(4-methylphenyl)methyl]piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]-N-[(4-pyridin-2-ylphenyl)methyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-[(1S)-1-benzyl-2-keto-2-[4-(4-methylbenzyl)piperazino]ethyl]-N-[4-(2-pyridyl)benzyl]-3-[4-(trifluoromethyl)phenyl]acrylamide Formula: C43H41F3N4O2 MolecularWeight: 702.80645

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C(CC3=CC=CC=C3)N(CC4=CC=C(C=C4)C5=CC=CC=N5)C(=O)C=CC6=CC=C(C=C6)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C(=O)[C@H](CC3=CC=CC=C3)N(CC4=CC=C(C=C4)C5=CC=CC=N5)C(=O)/C=C/C6=CC=C(C=C6)C(F)(F)F

InChI

InChI=1S/C43H41F3N4O2/c1-32-10-12-35(13-11-32)30-48-25-27-49(28-26-48)42(52)40(29-34-7-3-2-4-8-34)50(31-36-14-19-37(20-15-36)39-9-5-6-24-47-39)41(51)23-18-33-16-21-38(22-17-33)43(44,45)46/h2-24,40H,25-31H2,1H3/b23-18+/t40-/m0/s1