N'-(2-methoxy-4-methylsulfanyl-phenyl)carbonyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide

Systemtic Name: N'-(2-methoxy-4-methylsulfanyl-phenyl)carbonyl-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carbohydrazide Openeye Name: 3-benzyl-N'-(2-methoxy-4-methylsulfanyl-benzoyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[[2-methoxy-4-(methylthio)phenyl]-oxomethyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarbohydrazide IUPAC Name: 3-benzyl-N'-(2-methoxy-4-methylsulfanylbenzoyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-benzyl-4-keto-N'-[2-methoxy-4-(methylthio)benzoyl]phthalazine-1-carbohydrazide Formula: C25H22N4O4S MolecularWeight: 474.53158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O4S/c1-33-21-14-17(34-2)12-13-20(21)23(30)26-27-24(31)22-18-10-6-7-11-19(18)25(32)29(28-22)15-16-8-4-3-5-9-16/h3-14H,15H2,1-2H3,(H,26,30)(H,27,31)