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

Systemtic Name: 1-(2-methoxyethanoyl)-2-methyl-5-(4-methylphenyl)-4-(4-methylsulfanylphenyl)carbonyl-3-phenyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-(2-methoxyacetyl)-2-methyl-4-(4-methylsulfanylbenzoyl)-3-phenyl-5-(p-tolyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(2-methoxy-1-oxoethyl)-2-methyl-5-(4-methylphenyl)-4-[[4-(methylthio)phenyl]-oxomethyl]-3-phenyl-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-methoxyacetyl)-2-methyl-5-(4-methylphenyl)-4-(4-methylsulfanylbenzoyl)-3-phenylpyrrolidine-2-carboxylic acid Traditional Name: 1-(2-methoxyacetyl)-2-methyl-4-[4-(methylthio)benzoyl]-3-phenyl-5-(p-tolyl)proline Formula: C30H31NO5S MolecularWeight: 517.63584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)COC)(C)C(=O)O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)COC)(C)C(=O)O)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)SC

InChI

InChI=1S/C30H31NO5S/c1-19-10-12-21(13-11-19)27-25(28(33)22-14-16-23(37-4)17-15-22)26(20-8-6-5-7-9-20)30(2,29(34)35)31(27)24(32)18-36-3/h5-17,25-27H,18H2,1-4H3,(H,34,35)