2-[[5-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-[2-(4-iodophenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-[2-(4-iodophenyl)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[[2-(4-iodophenyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: 2-[[5-[2-(4-iodophenyl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-[[2-(4-iodophenyl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C12H10IN3O2S3 MolecularWeight: 451.32617

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CSC2=NN=C(S2)SCC(=O)N)I

Isomeric SMILES

C1=CC(=CC=C1C(=O)CSC2=NN=C(S2)SCC(=O)N)I

InChI

InChI=1S/C12H10IN3O2S3/c13-8-3-1-7(2-4-8)9(17)5-19-11-15-16-12(21-11)20-6-10(14)18/h1-4H,5-6H2,(H2,14,18)