5-fluoranyl-3-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonyl-1-benzofuran-2-carbohydrazide

Systemtic Name: 5-fluoranyl-3-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]carbonyl-1-benzofuran-2-carbohydrazide Openeye Name: 5-fluoro-3-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]benzofuran-2-carbohydrazide CAS Name: 5-fluoro-3-methyl-N'-[[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]phenyl]-oxomethyl]-2-benzofurancarbohydrazide IUPAC Name: 5-fluoro-3-methyl-N'-[4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzoyl]-1-benzofuran-2-carbohydrazide Traditional Name: 5-fluoro-3-methyl-N'-[4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzoyl]coumarilohydrazide Formula: C21H18FN5O3S MolecularWeight: 439.462723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)F)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NN=CN4C

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)F)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NN=CN4C

InChI

InChI=1S/C21H18FN5O3S/c1-12-16-9-15(22)7-8-17(16)30-18(12)20(29)25-24-19(28)14-5-3-13(4-6-14)10-31-21-26-23-11-27(21)2/h3-9,11H,10H2,1-2H3,(H,24,28)(H,25,29)