3-butoxy-N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide

Systemtic Name: 3-butoxy-N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide Openeye Name: 3-butoxy-N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide CAS Name: 3-butoxy-N-[5-[4-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 3-butoxy-N-[5-(4-methylsulfanylphenyl)-1,3,4-oxadiazol-2-yl]benzamide Traditional Name: 3-butoxy-N-[5-[4-(methylthio)phenyl]-1,3,4-oxadiazol-2-yl]benzamide Formula: C20H21N3O3S MolecularWeight: 383.46404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=NN=C(O2)C3=CC=C(C=C3)SC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=NN=C(O2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H21N3O3S/c1-3-4-12-25-16-7-5-6-15(13-16)18(24)21-20-23-22-19(26-20)14-8-10-17(27-2)11-9-14/h5-11,13H,3-4,12H2,1-2H3,(H,21,23,24)