4-oxidanylidene-N'-[3-(phenylsulfonylmethyl)furan-2-yl]carbonyl-3H-phthalazine-1-carbohydrazide

Systemtic Name: 4-oxidanylidene-N'-[3-(phenylsulfonylmethyl)furan-2-yl]carbonyl-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[3-(benzenesulfonylmethyl)furan-2-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[[3-(benzenesulfonylmethyl)-2-furanyl]-oxomethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[3-(benzenesulfonylmethyl)furan-2-carbonyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-[3-(besylmethyl)-2-furoyl]-4-keto-3H-phthalazine-1-carbohydrazide Formula: C21H16N4O6S MolecularWeight: 452.43994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CC2=C(OC=C2)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CC2=C(OC=C2)C(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H16N4O6S/c26-19-16-9-5-4-8-15(16)17(22-23-19)20(27)24-25-21(28)18-13(10-11-31-18)12-32(29,30)14-6-2-1-3-7-14/h1-11H,12H2,(H,23,26)(H,24,27)(H,25,28)