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

Systemtic Name: 3-butoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Openeye Name: 3-butoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide CAS Name: 3-butoxy-N-[5-[[4-(methylthio)phenyl]methyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 3-butoxy-N-[5-[(4-methylsulfanylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Traditional Name: 3-butoxy-N-[5-[4-(methylthio)benzyl]-1,3,4-oxadiazol-2-yl]benzamide Formula: C21H23N3O3S MolecularWeight: 397.49062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=NN=C(O2)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H23N3O3S/c1-3-4-12-26-17-7-5-6-16(14-17)20(25)22-21-24-23-19(27-21)13-15-8-10-18(28-2)11-9-15/h5-11,14H,3-4,12-13H2,1-2H3,(H,22,24,25)