N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenoxy-ethanamide

Systemtic Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenoxy-ethanamide Openeye Name: 2-phenoxy-N-(5-sec-butylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: N-[5-(butan-2-ylthio)-1,3,4-thiadiazol-2-yl]-2-phenoxyacetamide IUPAC Name: N-(5-butan-2-ylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide Traditional Name: 2-phenoxy-N-[5-(sec-butylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C14H17N3O2S2 MolecularWeight: 323.43368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=NN=C(S1)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCC(C)SC1=NN=C(S1)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C14H17N3O2S2/c1-3-10(2)20-14-17-16-13(21-14)15-12(18)9-19-11-7-5-4-6-8-11/h4-8,10H,3,9H2,1-2H3,(H,15,16,18)