(2S)-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(3,4-dimethoxyphenyl)methyl]-N-methyl-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-methyl-1-tosyl-N-veratryl-pyrrolidine-2-carboxamide Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)N(C)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N(C)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H28N2O5S/c1-16-7-10-18(11-8-16)30(26,27)24-13-5-6-19(24)22(25)23(2)15-17-9-12-20(28-3)21(14-17)29-4/h7-12,14,19H,5-6,13,15H2,1-4H3/t19-/m0/s1