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

Systemtic Name: methyl 2-[(4-fluorophenyl)methylcarbamoyl]-3-phenyl-4-(phenylcarbonyl)-5-thiophen-2-yl-pyrrolidine-1-carboxylate Openeye Name: methyl 4-benzoyl-2-[(4-fluorophenyl)methylcarbamoyl]-3-phenyl-5-(2-thienyl)pyrrolidine-1-carboxylate CAS Name: 4-benzoyl-2-[[(4-fluorophenyl)methylamino]-oxomethyl]-3-phenyl-5-thiophen-2-yl-1-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 4-benzoyl-2-[(4-fluorophenyl)methylcarbamoyl]-3-phenyl-5-thiophen-2-ylpyrrolidine-1-carboxylate Traditional Name: 4-benzoyl-2-[(4-fluorobenzyl)carbamoyl]-3-phenyl-5-(2-thienyl)pyrrolidine-1-carboxylic acid methyl ester Formula: C31H27FN2O4S MolecularWeight: 542.620483

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1C(C(C(C1C(=O)NCC2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

COC(=O)N1C(C(C(C1C(=O)NCC2=CC=C(C=C2)F)C3=CC=CC=C3)C(=O)C4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C31H27FN2O4S/c1-38-31(37)34-27(24-13-8-18-39-24)26(29(35)22-11-6-3-7-12-22)25(21-9-4-2-5-10-21)28(34)30(36)33-19-20-14-16-23(32)17-15-20/h2-18,25-28H,19H2,1H3,(H,33,36)