(E)-N-[(2S)-1-oxidanylidene-3-phenyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]-N-(1,3-thiazol-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-[(2S)-1-oxidanylidene-3-phenyl-1-[4-(phenylmethyl)piperazin-1-yl]propan-2-yl]-N-(1,3-thiazol-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-[(1S)-1-benzyl-2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-N-(thiazol-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-N-[(2S)-1-oxo-3-phenyl-1-[4-(phenylmethyl)-1-piperazinyl]propan-2-yl]-N-(2-thiazolylmethyl)-3-[4-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[(2S)-1-(4-benzylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]-N-(1,3-thiazol-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-[(1S)-1-benzyl-2-(4-benzylpiperazino)-2-keto-ethyl]-N-(thiazol-2-ylmethyl)-3-[4-(trifluoromethyl)phenyl]acrylamide Formula: C34H33F3N4O2S MolecularWeight: 618.71163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N(CC4=NC=CS4)C(=O)C=CC5=CC=C(C=C5)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)[C@H](CC3=CC=CC=C3)N(CC4=NC=CS4)C(=O)/C=C/C5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C34H33F3N4O2S/c35-34(36,37)29-14-11-26(12-15-29)13-16-32(42)41(25-31-38-17-22-44-31)30(23-27-7-3-1-4-8-27)33(43)40-20-18-39(19-21-40)24-28-9-5-2-6-10-28/h1-17,22,30H,18-21,23-25H2/b16-13+/t30-/m0/s1