2-(4-methylphenyl)sulfonyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazole

Systemtic Name: 2-(4-methylphenyl)sulfonyl-5-(phenylmethylsulfanyl)-1,3,4-thiadiazole Openeye Name: 2-benzylsulfanyl-5-(p-tolylsulfonyl)-1,3,4-thiadiazole CAS Name: 2-(4-methylphenyl)sulfonyl-5-(phenylmethylthio)-1,3,4-thiadiazole IUPAC Name: 2-benzylsulfanyl-5-(4-methylphenyl)sulfonyl-1,3,4-thiadiazole Traditional Name: 2-(benzylthio)-5-tosyl-1,3,4-thiadiazole Formula: C16H14N2O2S3 MolecularWeight: 362.48956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S3/c1-12-7-9-14(10-8-12)23(19,20)16-18-17-15(22-16)21-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3