(2S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[[4-(methoxymethyl)phenyl]methyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[4-(methoxymethyl)benzyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC3=CC=C(C=C3)COC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC3=CC=C(C=C3)COC

InChI

InChI=1S/C21H26N2O4S/c1-16-5-11-19(12-6-16)28(25,26)23-13-3-4-20(23)21(24)22-14-17-7-9-18(10-8-17)15-27-2/h5-12,20H,3-4,13-15H2,1-2H3,(H,22,24)/t20-/m0/s1