2-butylsulfanyl-5-(phenylsulfonylmethyl)-1,3,4-oxadiazole

Systemtic Name: 2-butylsulfanyl-5-(phenylsulfonylmethyl)-1,3,4-oxadiazole Openeye Name: 2-(benzenesulfonylmethyl)-5-butylsulfanyl-1,3,4-oxadiazole CAS Name: 2-(benzenesulfonylmethyl)-5-(butylthio)-1,3,4-oxadiazole IUPAC Name: 2-(benzenesulfonylmethyl)-5-butylsulfanyl-1,3,4-oxadiazole Traditional Name: 2-(besylmethyl)-5-(butylthio)-1,3,4-oxadiazole Formula: C13H16N2O3S2 MolecularWeight: 312.40774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(O1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCSC1=NN=C(O1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16N2O3S2/c1-2-3-9-19-13-15-14-12(18-13)10-20(16,17)11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3