methyl (4S)-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(3-phenylpropanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: methyl (4S)-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(3-phenylpropanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: methyl (4S)-1-benzyl-2-methyl-5-oxo-4-(3-phenylpropanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: (4S)-2-methyl-5-oxo-4-[(1-oxo-3-phenylpropyl)amino]-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl (4S)-1-benzyl-2-methyl-5-oxo-4-(3-phenylpropanoylamino)-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: (4S)-1-benzyl-4-(hydrocinnamoylamino)-5-keto-2-methyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C24H23F3N2O4 MolecularWeight: 460.44563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)CCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C([C@](C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)CCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C24H23F3N2O4/c1-16-20(21(31)33-2)23(24(25,26)27,22(32)29(16)15-18-11-7-4-8-12-18)28-19(30)14-13-17-9-5-3-6-10-17/h3-12H,13-15H2,1-2H3,(H,28,30)/t23-/m0/s1