N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[4-(4-fluorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[4-(4-fluorophenyl)-5-sulfanylidene-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[[4-(4-fluorophenyl)-5-thioxo-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C17H10F3N3O3S3 MolecularWeight: 457.46981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=S)SC(=N2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)F

Isomeric SMILES

C1=CC(=CC=C1N2C(=S)SC(=N2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F)F

InChI

InChI=1S/C17H10F3N3O3S3/c18-9-1-4-11(5-2-9)23-16(27)29-15(22-23)28-8-14(24)21-10-3-6-12-13(7-10)26-17(19,20)25-12/h1-7H,8H2,(H,21,24)