N'-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(4-fluoranyl-1-benzothiophen-2-yl)carbonyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(4-fluorobenzothiophene-2-carbonyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[(4-fluoro-1-benzothiophen-2-yl)-oxomethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(4-fluoro-1-benzothiophene-2-carbonyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-(4-fluorobenzothiophene-2-carbonyl)-4-keto-phthalazine-1-carbohydrazide Formula: C23H21FN4O3S MolecularWeight: 452.501243

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC4=C(C=CC=C4S3)F

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC4=C(C=CC=C4S3)F

InChI

InChI=1S/C23H21FN4O3S/c1-2-3-6-12-28-23(31)15-9-5-4-8-14(15)20(27-28)22(30)26-25-21(29)19-13-16-17(24)10-7-11-18(16)32-19/h4-5,7-11,13H,2-3,6,12H2,1H3,(H,25,29)(H,26,30)