N'-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-(3-cyano-4,5,6-trimethyl-pyridin-2-yl)sulfanylethanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)sulfanyl]acetyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)thio]-1-oxoethyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-[2-[(3-cyano-4,5,6-trimethyl-2-pyridyl)thio]acetyl]-4-keto-3H-phthalazine-1-carbohydrazide Formula: C20H18N6O3S MolecularWeight: 422.46032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=C(N=C(C(=C1C)C#N)SCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C20H18N6O3S/c1-10-11(2)15(8-21)20(22-12(10)3)30-9-16(27)23-26-19(29)17-13-6-4-5-7-14(13)18(28)25-24-17/h4-7H,9H2,1-3H3,(H,23,27)(H,25,28)(H,26,29)