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

Systemtic Name: 3,5-bis[(4-nitrophenyl)methylsulfanyl]-1,2,4-thiadiazole Openeye Name: 3,5-bis[(4-nitrophenyl)methylsulfanyl]-1,2,4-thiadiazole CAS Name: 3,5-bis[(4-nitrophenyl)methylthio]-1,2,4-thiadiazole IUPAC Name: 3,5-bis[(4-nitrophenyl)methylsulfanyl]-1,2,4-thiadiazole Traditional Name: 3,5-bis[(4-nitrobenzyl)thio]-1,2,4-thiadiazole Formula: C16H12N4O4S3 MolecularWeight: 420.48588

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NSC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CSC2=NSC(=N2)SCC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N4O4S3/c21-19(22)13-5-1-11(2-6-13)9-25-15-17-16(27-18-15)26-10-12-3-7-14(8-4-12)20(23)24/h1-8H,9-10H2