N'-octanoyl-1-oxidanylidene-isothiochromene-3-carbohydrazide

Systemtic Name: N'-octanoyl-1-oxidanylidene-isothiochromene-3-carbohydrazide Openeye Name: N'-octanoyl-1-oxo-isothiochromene-3-carbohydrazide CAS Name: 1-oxo-N'-(1-oxooctyl)-2-benzothiopyran-3-carbohydrazide IUPAC Name: N'-octanoyl-1-oxoisothiochromene-3-carbohydrazide Traditional Name: N'-caprylyl-1-keto-isothiochromene-3-carbohydrazide Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NNC(=O)C1=CC2=CC=CC=C2C(=O)S1

Isomeric SMILES

CCCCCCCC(=O)NNC(=O)C1=CC2=CC=CC=C2C(=O)S1

InChI

InChI=1S/C18H22N2O3S/c1-2-3-4-5-6-11-16(21)19-20-17(22)15-12-13-9-7-8-10-14(13)18(23)24-15/h7-10,12H,2-6,11H2,1H3,(H,19,21)(H,20,22)