5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: N-benzyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(4-chlorophenyl)sulfonylethylthio]-N-(phenylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: N-benzyl-5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: benzyl-[5-[2-(4-chlorophenyl)sulfonylethylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C17H16ClN3O2S3 MolecularWeight: 425.97584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NN=C(S2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NN=C(S2)SCCS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16ClN3O2S3/c18-14-6-8-15(9-7-14)26(22,23)11-10-24-17-21-20-16(25-17)19-12-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,19,20)