3-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 3-[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 3-[[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile IUPAC Name: 3-[[4-(4-chlorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 3-[[[4-(4-chlorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]methyl]benzonitrile Formula: C16H10ClN3S3 MolecularWeight: 375.9187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CSC2=NN(C(=S)S2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)CSC2=NN(C(=S)S2)C3=CC=C(C=C3)Cl)C#N

InChI

InChI=1S/C16H10ClN3S3/c17-13-4-6-14(7-5-13)20-16(21)23-15(19-20)22-10-12-3-1-2-11(8-12)9-18/h1-8H,10H2