4-oxidanylidene-3-pentyl-N'-[(2S)-2-phenylsulfanylpropanoyl]phthalazine-1-carbohydrazide

Systemtic Name: 4-oxidanylidene-3-pentyl-N'-[(2S)-2-phenylsulfanylpropanoyl]phthalazine-1-carbohydrazide Openeye Name: 4-oxo-3-pentyl-N'-[(2S)-2-phenylsulfanylpropanoyl]phthalazine-1-carbohydrazide CAS Name: 4-oxo-N'-[(2S)-1-oxo-2-(phenylthio)propyl]-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: 4-oxo-3-pentyl-N'-[(2S)-2-phenylsulfanylpropanoyl]phthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-[(2S)-2-(phenylthio)propanoyl]phthalazine-1-carbohydrazide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C(C)SC3=CC=CC=C3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)[C@H](C)SC3=CC=CC=C3

InChI

InChI=1S/C23H26N4O3S/c1-3-4-10-15-27-23(30)19-14-9-8-13-18(19)20(26-27)22(29)25-24-21(28)16(2)31-17-11-6-5-7-12-17/h5-9,11-14,16H,3-4,10,15H2,1-2H3,(H,24,28)(H,25,29)/t16-/m0/s1