N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)phenyl]carbonyl-3-methyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-3-methyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[[4-[(1H-benzimidazol-2-ylthio)methyl]phenyl]-oxomethyl]-3-methyl-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-[4-(1H-benzimidazol-2-ylsulfanylmethyl)benzoyl]-3-methyl-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-[4-[(1H-benzimidazol-2-ylthio)methyl]benzoyl]-4-keto-3-methyl-phthalazine-1-carbohydrazide Formula: C25H20N6O3S MolecularWeight: 484.5297

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H20N6O3S/c1-31-24(34)18-7-3-2-6-17(18)21(30-31)23(33)29-28-22(32)16-12-10-15(11-13-16)14-35-25-26-19-8-4-5-9-20(19)27-25/h2-13H,14H2,1H3,(H,26,27)(H,28,32)(H,29,33)