3-(cyclohexylsulfanylmethyl)-N'-(3-methylbutanoyl)-1-benzofuran-2-carbohydrazide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N'-(3-methylbutanoyl)-1-benzofuran-2-carbohydrazide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N'-(3-methylbutanoyl)benzofuran-2-carbohydrazide CAS Name: 3-[(cyclohexylthio)methyl]-N'-(3-methyl-1-oxobutyl)-2-benzofurancarbohydrazide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N'-(3-methylbutanoyl)-1-benzofuran-2-carbohydrazide Traditional Name: 3-[(cyclohexylthio)methyl]-N'-isovaleryl-coumarilohydrazide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

Isomeric SMILES

CC(C)CC(=O)NNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

InChI

InChI=1S/C21H28N2O3S/c1-14(2)12-19(24)22-23-21(25)20-17(13-27-15-8-4-3-5-9-15)16-10-6-7-11-18(16)26-20/h6-7,10-11,14-15H,3-5,8-9,12-13H2,1-2H3,(H,22,24)(H,23,25)