N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide

Systemtic Name: N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-(phenylmethyl)sulfonyl-propanamide Openeye Name: 3-benzylsulfonyl-N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide CAS Name: N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]-3-(phenylmethyl)sulfonylpropanamide IUPAC Name: 3-benzylsulfonyl-N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]propanamide Traditional Name: 3-benzylsulfonyl-N-[5-(2,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]propionamide Formula: C20H21N3O6S MolecularWeight: 431.46224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=NN=C(O2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=NN=C(O2)NC(=O)CCS(=O)(=O)CC3=CC=CC=C3)OC

InChI

InChI=1S/C20H21N3O6S/c1-27-15-8-9-16(17(12-15)28-2)19-22-23-20(29-19)21-18(24)10-11-30(25,26)13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3,(H,21,23,24)