1-(2-methoxyethanoyl)-2-methyl-4-(4-methylsulfanylphenyl)carbonyl-3-phenyl-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-methoxyethanoyl)-2-methyl-4-(4-methylsulfanylphenyl)carbonyl-3-phenyl-5-thiophen-2-yl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-methoxyacetyl)-2-methyl-4-(4-methylsulfanylbenzoyl)-3-phenyl-5-(2-thienyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(2-methoxy-1-oxoethyl)-2-methyl-4-[[4-(methylthio)phenyl]-oxomethyl]-3-phenyl-5-thiophen-2-yl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-methoxyacetyl)-2-methyl-4-(4-methylsulfanylbenzoyl)-3-phenyl-5-thiophen-2-ylpyrrolidine-2-carboxylic acid Traditional Name: 1-(2-methoxyacetyl)-2-methyl-4-[4-(methylthio)benzoyl]-3-phenyl-5-(2-thienyl)proline Formula: C27H27NO5S2 MolecularWeight: 509.63698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)COC)C2=CC=CS2)C(=O)C3=CC=C(C=C3)SC)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)COC)C2=CC=CS2)C(=O)C3=CC=C(C=C3)SC)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C27H27NO5S2/c1-27(26(31)32)23(17-8-5-4-6-9-17)22(25(30)18-11-13-19(34-3)14-12-18)24(20-10-7-15-35-20)28(27)21(29)16-33-2/h4-15,22-24H,16H2,1-3H3,(H,31,32)