methyl 1-(4-bromophenyl)sulfonyl-2,4-diphenyl-5-(1-phenylethylcarbamoyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 1-(4-bromophenyl)sulfonyl-2,4-diphenyl-5-(1-phenylethylcarbamoyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-bromophenyl)sulfonyl-2,4-diphenyl-5-(1-phenylethylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-(4-bromophenyl)sulfonyl-5-[oxo-(1-phenylethylamino)methyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromophenyl)sulfonyl-2,4-diphenyl-5-(1-phenylethylcarbamoyl)pyrrolidine-3-carboxylate Traditional Name: 1-brosyl-2,4-diphenyl-5-(1-phenylethylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C33H31BrN2O5S MolecularWeight: 647.57864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C2C(C(C(N2S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=O)C2C(C(C(N2S(=O)(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C(=O)OC)C5=CC=CC=C5

InChI

InChI=1S/C33H31BrN2O5S/c1-22(23-12-6-3-7-13-23)35-32(37)31-28(24-14-8-4-9-15-24)29(33(38)41-2)30(25-16-10-5-11-17-25)36(31)42(39,40)27-20-18-26(34)19-21-27/h3-22,28-31H,1-2H3,(H,35,37)