N'-(3-methylsulfanylpropanoyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3-methylsulfanylpropanoyl)-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-(3-methylsulfanylpropanoyl)-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[3-(methylthio)-1-oxopropyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(3-methylsulfanylpropanoyl)-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-4-keto-N'-[3-(methylthio)propanoyl]phthalazine-1-carbohydrazide Formula: C18H24N4O3S MolecularWeight: 376.47316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCSC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCSC

InChI

InChI=1S/C18H24N4O3S/c1-3-4-7-11-22-18(25)14-9-6-5-8-13(14)16(21-22)17(24)20-19-15(23)10-12-26-2/h5-6,8-9H,3-4,7,10-12H2,1-2H3,(H,19,23)(H,20,24)