4-cyano-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]benzamide

Systemtic Name: 4-cyano-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]benzamide Openeye Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-4-cyano-benzamide CAS Name: 4-cyano-N-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]benzamide IUPAC Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-4-cyanobenzamide Traditional Name: N-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]-4-cyano-benzamide Formula: C17H12N4OS2 MolecularWeight: 352.43338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H12N4OS2/c18-10-12-6-8-14(9-7-12)15(22)19-16-20-17(21-24-16)23-11-13-4-2-1-3-5-13/h1-9H,11H2,(H,19,20,21,22)