3-ethyl-N'-[2-[(4-methylphenyl)methylsulfanyl]ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-ethyl-N'-[2-[(4-methylphenyl)methylsulfanyl]ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-ethyl-4-oxo-N'-[2-(p-tolylmethylsulfanyl)acetyl]phthalazine-1-carbohydrazide CAS Name: 3-ethyl-N'-[2-[(4-methylphenyl)methylthio]-1-oxoethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-ethyl-N'-[2-[(4-methylphenyl)methylsulfanyl]acetyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-ethyl-4-keto-N'-[2-[(4-methylbenzyl)thio]acetyl]phthalazine-1-carbohydrazide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSCC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-3-25-21(28)17-7-5-4-6-16(17)19(24-25)20(27)23-22-18(26)13-29-12-15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,22,26)(H,23,27)