4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclopropylcarbonyl-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclopropylcarbonyl-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methyl-pyrrolidine-2-carboxylic acid CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[cyclopropyl(oxo)methyl]-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methyl-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methylpyrrolidine-2-carboxylic acid Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-methyl-proline Formula: C28H25ClFNO5S MolecularWeight: 542.018203

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2CC2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(S4)Cl)C5=CC(=CC=C5)OC)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2CC2)C3=CC=C(C=C3)F)C(=O)C4=CC=C(S4)Cl)C5=CC(=CC=C5)OC)C(=O)O

InChI

InChI=1S/C28H25ClFNO5S/c1-28(27(34)35)23(17-4-3-5-19(14-17)36-2)22(25(32)20-12-13-21(29)37-20)24(15-8-10-18(30)11-9-15)31(28)26(33)16-6-7-16/h3-5,8-14,16,22-24H,6-7H2,1-2H3,(H,34,35)