(2S)-N-(2-ethyl-6-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(2-ethyl-6-methylphenyl)-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(2-ethyl-6-methylphenyl)-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-(2-ethyl-6-methyl-phenyl)-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)[C@@H]2CCCN2S(=O)(=O)C3=CC=C(C=C3)C)C

InChI

InChI=1S/C21H26N2O3S/c1-4-17-8-5-7-16(3)20(17)22-21(24)19-9-6-14-23(19)27(25,26)18-12-10-15(2)11-13-18/h5,7-8,10-13,19H,4,6,9,14H2,1-3H3,(H,22,24)/t19-/m0/s1