methyl 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate

Systemtic Name: methyl 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Openeye Name: methyl 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate CAS Name: 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-[[(4-methoxyphenyl)methylamino]-oxomethyl]-3-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-[(4-methoxyphenyl)methylcarbamoyl]pyrrolidine-3-carboxylate Traditional Name: 2-(4-tert-butylphenyl)-1-(3-chlorophenyl)sulfonyl-5-(p-anisylcarbamoyl)pyrrolidine-3-carboxylic acid methyl ester Formula: C31H35ClN2O6S MolecularWeight: 599.1374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2C(CC(N2S(=O)(=O)C3=CC(=CC=C3)Cl)C(=O)NCC4=CC=C(C=C4)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2C(CC(N2S(=O)(=O)C3=CC(=CC=C3)Cl)C(=O)NCC4=CC=C(C=C4)OC)C(=O)OC

InChI

InChI=1S/C31H35ClN2O6S/c1-31(2,3)22-13-11-21(12-14-22)28-26(30(36)40-5)18-27(29(35)33-19-20-9-15-24(39-4)16-10-20)34(28)41(37,38)25-8-6-7-23(32)17-25/h6-17,26-28H,18-19H2,1-5H3,(H,33,35)