N'-[(3S)-1-ethanoylpiperidin-3-yl]carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[(3S)-1-ethanoylpiperidin-3-yl]carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-[(3S)-1-acetylpiperidine-3-carbonyl]-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[[(3S)-1-acetyl-3-piperidinyl]-oxomethyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[(3S)-1-acetylpiperidine-3-carbonyl]-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-[(3S)-1-acetylnipecotoyl]-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C20H25N5O4 MolecularWeight: 399.4436

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CCCN(C3)C(=O)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)[C@H]3CCCN(C3)C(=O)C

InChI

InChI=1S/C20H25N5O4/c1-3-10-25-20(29)16-9-5-4-8-15(16)17(23-25)19(28)22-21-18(27)14-7-6-11-24(12-14)13(2)26/h4-5,8-9,14H,3,6-7,10-12H2,1-2H3,(H,21,27)(H,22,28)/t14-/m0/s1