3-ethyl-N'-[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-ethyl-N'-[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]ethanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-ethyl-4-oxo-N'-[2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]phthalazine-1-carbohydrazide CAS Name: 3-ethyl-N'-[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-1-oxoethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-ethyl-N'-[2-[3-(4-methylphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]acetyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-ethyl-4-keto-N'-[2-[3-(p-tolyl)-5-thioxo-1H-1,2,4-triazol-4-yl]acetyl]phthalazine-1-carbohydrazide Formula: C22H21N7O3S MolecularWeight: 463.51224

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN3C(=NNC3=S)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN3C(=NNC3=S)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H21N7O3S/c1-3-29-21(32)16-7-5-4-6-15(16)18(27-29)20(31)25-23-17(30)12-28-19(24-26-22(28)33)14-10-8-13(2)9-11-14/h4-11H,3,12H2,1-2H3,(H,23,30)(H,25,31)(H,26,33)