ethyl 5-[(4-fluorophenyl)methylcarbamoyl]-4-methyl-2-phenyl-1-(phenylsulfonyl)pyrrolidine-3-carboxylate

Systemtic Name: ethyl 5-[(4-fluorophenyl)methylcarbamoyl]-4-methyl-2-phenyl-1-(phenylsulfonyl)pyrrolidine-3-carboxylate Openeye Name: ethyl 1-(benzenesulfonyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-methyl-2-phenyl-pyrrolidine-3-carboxylate CAS Name: 1-(benzenesulfonyl)-5-[[(4-fluorophenyl)methylamino]-oxomethyl]-4-methyl-2-phenyl-3-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(benzenesulfonyl)-5-[(4-fluorophenyl)methylcarbamoyl]-4-methyl-2-phenylpyrrolidine-3-carboxylate Traditional Name: 1-besyl-5-[(4-fluorobenzyl)carbamoyl]-4-methyl-2-phenyl-pyrrolidine-3-carboxylic acid ethyl ester Formula: C28H29FN2O5S MolecularWeight: 524.603663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F)C

Isomeric SMILES

CCOC(=O)C1C(C(N(C1C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)F)C

InChI

InChI=1S/C28H29FN2O5S/c1-3-36-28(33)24-19(2)25(27(32)30-18-20-14-16-22(29)17-15-20)31(26(24)21-10-6-4-7-11-21)37(34,35)23-12-8-5-9-13-23/h4-17,19,24-26H,3,18H2,1-2H3,(H,30,32)