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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CN(CC2C(=O)NCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2CN(CC2C(=O)NCC3=CN=CC=C3)S(=O)(=O)C4=CC=CC=C4)OC

InChI

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