N'-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-(4-methylquinolin-2-yl)sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[2-[(4-methyl-2-quinolyl)sulfanyl]acetyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[2-[(4-methyl-2-quinolinyl)thio]-1-oxoethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[2-(4-methylquinolin-2-yl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-[2-[(4-methyl-2-quinolyl)thio]acetyl]-3H-phthalazine-1-carbohydrazide Formula: C21H17N5O3S MolecularWeight: 419.45638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C21H17N5O3S/c1-12-10-18(22-16-9-5-4-6-13(12)16)30-11-17(27)23-26-21(29)19-14-7-2-3-8-15(14)20(28)25-24-19/h2-10H,11H2,1H3,(H,23,27)(H,25,28)(H,26,29)