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

Systemtic Name: 3-(phenylsulfonylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide Openeye Name: 3-(benzenesulfonylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-(benzenesulfonylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2,4-oxadiazole-5-carboxamide Traditional Name: 3-(besylmethyl)-N-(3,4,5-trimethoxybenzyl)-1,2,4-oxadiazole-5-carboxamide Formula: C20H21N3O7S MolecularWeight: 447.46164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=NC(=NO2)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H21N3O7S/c1-27-15-9-13(10-16(28-2)18(15)29-3)11-21-19(24)20-22-17(23-30-20)12-31(25,26)14-7-5-4-6-8-14/h4-10H,11-12H2,1-3H3,(H,21,24)