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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(S2)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=NN=C(S2)SCC3=CC=C(C=C3)Cl

InChI

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