2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[(4-nitrophenyl)methylthio]-1,3,4-thiadiazole IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[(4-chlorobenzyl)thio]-5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazole Formula: C16H12ClN3O2S3 MolecularWeight: 409.93338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN=C(S2)SCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN=C(S2)SCC3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN3O2S3/c17-13-5-1-11(2-6-13)9-23-15-18-19-16(25-15)24-10-12-3-7-14(8-4-12)20(21)22/h1-8H,9-10H2