S-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl) 4-chloranylbenzenecarbothioate

Systemtic Name: S-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl) 4-chloranylbenzenecarbothioate Openeye Name: S-[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl] 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl) ester IUPAC Name: S-(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl) 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl] ester Formula: C14H8ClN3O2S MolecularWeight: 317.75022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SC2=NN=C(O2)C3=CC=NC=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)SC2=NN=C(O2)C3=CC=NC=C3)Cl

InChI

InChI=1S/C14H8ClN3O2S/c15-11-3-1-10(2-4-11)13(19)21-14-18-17-12(20-14)9-5-7-16-8-6-9/h1-8H