1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(4-butylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio]ethanone Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(O2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H22N2O3S/c1-3-4-7-15-10-12-16(13-11-15)18(24)14-27-21-23-22-20(26-21)17-8-5-6-9-19(17)25-2/h5-6,8-13H,3-4,7,14H2,1-2H3