N'-[[3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-yl]carbonyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide

Systemtic Name: N'-[[3-[(phenylmethylsulfanyl)methyl]-1-benzofuran-2-yl]carbonyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Openeye Name: N'-[3-(benzylsulfanylmethyl)benzofuran-2-carbonyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide CAS Name: N'-[oxo-[3-[(phenylmethylthio)methyl]-2-benzofuranyl]methyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide IUPAC Name: N'-[3-(benzylsulfanylmethyl)-1-benzofuran-2-carbonyl]-2,3-dihydro-1,4-benzodioxine-3-carbohydrazide Traditional Name: N'-[3-[(benzylthio)methyl]benzofuran-2-carbonyl]-2,3-dihydro-1,4-benzodioxin-3-carbohydrazide Formula: C26H22N2O5S MolecularWeight: 474.52828

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

Isomeric SMILES

C1C(OC2=CC=CC=C2O1)C(=O)NNC(=O)C3=C(C4=CC=CC=C4O3)CSCC5=CC=CC=C5

InChI

InChI=1S/C26H22N2O5S/c29-25(23-14-31-21-12-6-7-13-22(21)32-23)27-28-26(30)24-19(18-10-4-5-11-20(18)33-24)16-34-15-17-8-2-1-3-9-17/h1-13,23H,14-16H2,(H,27,29)(H,28,30)