methyl 2,4-diphenyl-1-(phenylsulfonyl)-5-(propylcarbamoyl)pyrrolidine-3-carboxylate

Systemtic Name: methyl 2,4-diphenyl-1-(phenylsulfonyl)-5-(propylcarbamoyl)pyrrolidine-3-carboxylate Openeye Name: methyl 1-(benzenesulfonyl)-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylate CAS Name: 1-(benzenesulfonyl)-5-[oxo(propylamino)methyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(benzenesulfonyl)-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylate Traditional Name: 1-besyl-2,4-diphenyl-5-(propylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C28H30N2O5S MolecularWeight: 506.6132

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1C(C(C(N1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CCCNC(=O)C1C(C(C(N1S(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H30N2O5S/c1-3-19-29-27(31)26-23(20-13-7-4-8-14-20)24(28(32)35-2)25(21-15-9-5-10-16-21)30(26)36(33,34)22-17-11-6-12-18-22/h4-18,23-26H,3,19H2,1-2H3,(H,29,31)