methyl 1-cyclopropylcarbonyl-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-cyclopropylcarbonyl-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-2-thiophen-2-yl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(cyclopropanecarbonyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-2-(2-thienyl)pyrrolidine-3-carboxylate CAS Name: 1-[cyclopropyl(oxo)methyl]-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-4-phenyl-2-thiophen-2-yl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(cyclopropanecarbonyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-phenyl-2-thiophen-2-ylpyrrolidine-3-carboxylate Traditional Name: 1-(cyclopropanecarbonyl)-5-[(4-fluorobenzyl)carbamoyl]-4-phenyl-2-(2-thienyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C28H27FN2O4S MolecularWeight: 506.588383

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(N(C1C2=CC=CS2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1C(C(N(C1C2=CC=CS2)C(=O)C3CC3)C(=O)NCC4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C28H27FN2O4S/c1-35-28(34)23-22(18-6-3-2-4-7-18)25(26(32)30-16-17-9-13-20(29)14-10-17)31(27(33)19-11-12-19)24(23)21-8-5-15-36-21/h2-10,13-15,19,22-25H,11-12,16H2,1H3,(H,30,32)