[(3S)-4,4-dimethyl-2-oxidanylidene-1-phenyl-pyrrolidin-3-yl] (2S)-2-(4-thiophen-2-ylcarbonylphenyl)propanoate

Systemtic Name: [(3S)-4,4-dimethyl-2-oxidanylidene-1-phenyl-pyrrolidin-3-yl] (2S)-2-(4-thiophen-2-ylcarbonylphenyl)propanoate Openeye Name: [(3S)-4,4-dimethyl-2-oxo-1-phenyl-pyrrolidin-3-yl] (2S)-2-[4-(thiophene-2-carbonyl)phenyl]propanoate CAS Name: (2S)-2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid [(3S)-4,4-dimethyl-2-oxo-1-phenyl-3-pyrrolidinyl] ester IUPAC Name: [(3S)-4,4-dimethyl-2-oxo-1-phenylpyrrolidin-3-yl] (2S)-2-[4-(thiophene-2-carbonyl)phenyl]propanoate Traditional Name: (2S)-2-[4-(2-thenoyl)phenyl]propionic acid [(3S)-2-keto-4,4-dimethyl-1-phenyl-pyrrolidin-3-yl] ester Formula: C26H25NO4S MolecularWeight: 447.546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)OC3C(=O)N(CC3(C)C)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)C(=O)C2=CC=CS2)C(=O)O[C@@H]3C(=O)N(CC3(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H25NO4S/c1-17(18-11-13-19(14-12-18)22(28)21-10-7-15-32-21)25(30)31-23-24(29)27(16-26(23,2)3)20-8-5-4-6-9-20/h4-15,17,23H,16H2,1-3H3/t17-,23+/m0/s1