N-(2-chloranyl-5-methylsulfonyl-phenyl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carboxamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-5-keto-1-(4-methylbenzyl)pyrrolidine-3-carboxamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C20H21ClN2O4S/c1-13-3-5-14(6-4-13)11-23-12-15(9-19(23)24)20(25)22-18-10-16(28(2,26)27)7-8-17(18)21/h3-8,10,15H,9,11-12H2,1-2H3,(H,22,25)