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

Systemtic Name: N'-[2-(4-methylphenyl)sulfanylethanoyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carbohydrazide Openeye Name: 3-isopropyl-4-oxo-N'-[2-(p-tolylsulfanyl)acetyl]phthalazine-1-carbohydrazide CAS Name: N'-[2-[(4-methylphenyl)thio]-1-oxoethyl]-4-oxo-3-propan-2-yl-1-phthalazinecarbohydrazide IUPAC Name: N'-[2-(4-methylphenyl)sulfanylacetyl]-4-oxo-3-propan-2-ylphthalazine-1-carbohydrazide Traditional Name: 3-isopropyl-4-keto-N'-[2-(p-tolylthio)acetyl]phthalazine-1-carbohydrazide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C(C)C

InChI

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