N'-(6-chloranylpyridin-3-yl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(6-chloranylpyridin-3-yl)carbonyl-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(6-chloropyridine-3-carbonyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[(6-chloro-3-pyridinyl)-oxomethyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(6-chloropyridine-3-carbonyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-(6-chloronicotinoyl)-4-keto-phthalazine-1-carbohydrazide Formula: C20H20ClN5O3 MolecularWeight: 413.8575

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN5O3/c1-2-3-6-11-26-20(29)15-8-5-4-7-14(15)17(25-26)19(28)24-23-18(27)13-9-10-16(21)22-12-13/h4-5,7-10,12H,2-3,6,11H2,1H3,(H,23,27)(H,24,28)