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

Systemtic Name: 4-(5-chloranylthiophen-2-yl)carbonyl-1-cyclopropylcarbonyl-5-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrrolidine-2-carboxylic acid Openeye Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrrolidine-2-carboxylic acid CAS Name: 4-[(5-chloro-2-thiophenyl)-oxomethyl]-1-[cyclopropyl(oxo)methyl]-5-(4-fluorophenyl)-3-(3-methoxyphenyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)pyrrolidine-2-carboxylic acid Traditional Name: 4-(5-chlorothiophene-2-carbonyl)-1-(cyclopropanecarbonyl)-5-(4-fluorophenyl)-3-(3-methoxyphenyl)proline Formula: C27H23ClFNO5S MolecularWeight: 527.991623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=C(S5)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2C(C(N(C2C(=O)O)C(=O)C3CC3)C4=CC=C(C=C4)F)C(=O)C5=CC=C(S5)Cl

InChI

InChI=1S/C27H23ClFNO5S/c1-35-18-4-2-3-16(13-18)21-22(25(31)19-11-12-20(28)36-19)23(14-7-9-17(29)10-8-14)30(24(21)27(33)34)26(32)15-5-6-15/h2-4,7-13,15,21-24H,5-6H2,1H3,(H,33,34)