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

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-5-(phenylmethylsulfanyl)-1,3,4-thiadiazole Openeye Name: 2-benzylsulfanyl-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[(4-nitrophenyl)methylthio]-5-(phenylmethylthio)-1,3,4-thiadiazole IUPAC Name: 2-benzylsulfanyl-5-[(4-nitrophenyl)methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-(benzylthio)-5-[(4-nitrobenzyl)thio]-1,3,4-thiadiazole Formula: C16H13N3O2S3 MolecularWeight: 375.48832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O2S3/c20-19(21)14-8-6-13(7-9-14)11-23-16-18-17-15(24-16)22-10-12-4-2-1-3-5-12/h1-9H,10-11H2