N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[(4-cyclopropyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[(4-cyclopropyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[(4-cyclopropyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C13H12BrFN4O2S MolecularWeight: 387.227383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)NN=C2SCC(=O)NC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CC1N2C(=O)NN=C2SCC(=O)NC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C13H12BrFN4O2S/c14-7-1-4-10(9(15)5-7)16-11(20)6-22-13-18-17-12(21)19(13)8-2-3-8/h1,4-5,8H,2-3,6H2,(H,16,20)(H,17,21)