N-[(3,4-dimethoxyphenyl)methyl]-3-(phenylsulfonylmethyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(phenylsulfonylmethyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-[(3,4-dimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-(besylmethyl)-N-veratryl-1,2,4-oxadiazole-5-carboxamide Formula: C19H19N3O6S MolecularWeight: 417.43566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H19N3O6S/c1-26-15-9-8-13(10-16(15)27-2)11-20-18(23)19-21-17(22-28-19)12-29(24,25)14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3,(H,20,23)