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

Systemtic Name: methyl 1-(4-bromophenyl)sulfonyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate Openeye Name: methyl 1-(4-bromophenyl)sulfonyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylate CAS Name: 1-(4-bromophenyl)sulfonyl-5-[(cyclopropylmethylamino)-oxomethyl]-2,4-diphenyl-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromophenyl)sulfonyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenylpyrrolidine-3-carboxylate Traditional Name: 1-brosyl-5-(cyclopropylmethylcarbamoyl)-2,4-diphenyl-pyrrolidine-3-carboxylic acid methyl ester Formula: C29H29BrN2O5S MolecularWeight: 597.51996

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(C(N(C1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C(=O)NCC4CC4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1C(C(N(C1C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Br)C(=O)NCC4CC4)C5=CC=CC=C5

InChI

InChI=1S/C29H29BrN2O5S/c1-37-29(34)25-24(20-8-4-2-5-9-20)27(28(33)31-18-19-12-13-19)32(26(25)21-10-6-3-7-11-21)38(35,36)23-16-14-22(30)15-17-23/h2-11,14-17,19,24-27H,12-13,18H2,1H3,(H,31,33)