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

Systemtic Name: N'-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]-3H-phthalazine-1-carbohydrazide Formula: C19H16N6O3S MolecularWeight: 408.43374

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CN1C2=CC=CC=C2N=C1SCC(=O)NNC(=O)C3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C19H16N6O3S/c1-25-14-9-5-4-8-13(14)20-19(25)29-10-15(26)21-24-18(28)16-11-6-2-3-7-12(11)17(27)23-22-16/h2-9H,10H2,1H3,(H,21,26)(H,23,27)(H,24,28)