N'-[2-[2,5-bis(fluoranyl)phenyl]sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-[2,5-bis(fluoranyl)phenyl]sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[2-(2,5-difluorophenyl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[2-[(2,5-difluorophenyl)thio]-1-oxoethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[2-(2,5-difluorophenyl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-[2-[(2,5-difluorophenyl)thio]acetyl]-4-keto-3H-phthalazine-1-carbohydrazide Formula: C17H12F2N4O3S MolecularWeight: 390.363986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)CSC3=C(C=CC(=C3)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)C(=O)NNC(=O)CSC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C17H12F2N4O3S/c18-9-5-6-12(19)13(7-9)27-8-14(24)20-23-17(26)15-10-3-1-2-4-11(10)16(25)22-21-15/h1-7H,8H2,(H,20,24)(H,22,25)(H,23,26)