N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C17H12F2N4O3S MolecularWeight: 390.363986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCC(=O)NC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C17H12F2N4O3S/c18-17(19)25-12-7-6-11(8-13(12)26-17)20-14(24)9-27-16-21-15(22-23-16)10-4-2-1-3-5-10/h1-8H,9H2,(H,20,24)(H,21,22,23)