(2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-methyl-N-[2-(2-methylphenoxy)ethyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C)CCOC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N(C)CCOC3=CC=CC=C3C

InChI

InChI=1S/C22H28N2O4S/c1-17-10-12-19(13-11-17)29(26,27)24-14-6-8-20(24)22(25)23(3)15-16-28-21-9-5-4-7-18(21)2/h4-5,7,9-13,20H,6,8,14-16H2,1-3H3/t20-/m0/s1