4-(2,3-dimethoxyphenyl)-1-(phenylsulfonyl)-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: 4-(2,3-dimethoxyphenyl)-1-(phenylsulfonyl)-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-4-(2,3-dimethoxyphenyl)-N-(2-pyridylmethyl)pyrrolidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-4-(2,3-dimethoxyphenyl)-N-(2-pyridinylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-4-(2,3-dimethoxyphenyl)-N-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide Traditional Name: 1-besyl-4-(2,3-dimethoxyphenyl)-N-(2-pyridylmethyl)pyrrolidine-3-carboxamide Formula: C25H27N3O5S MolecularWeight: 481.56398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC(=C1OC)C2CN(CC2C(=O)NCC3=CC=CC=N3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O5S/c1-32-23-13-8-12-20(24(23)33-2)21-16-28(34(30,31)19-10-4-3-5-11-19)17-22(21)25(29)27-15-18-9-6-7-14-26-18/h3-14,21-22H,15-17H2,1-2H3,(H,27,29)