N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide

Systemtic Name: N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-4-oxidanylidene-3H-phthalazine-1-carbohydrazide Openeye Name: N'-[3-(4,6-dimethyl-2-methylsulfanyl-pyrimidin-5-yl)propanoyl]-4-oxo-3H-phthalazine-1-carbohydrazide CAS Name: N'-[3-[4,6-dimethyl-2-(methylthio)-5-pyrimidinyl]-1-oxopropyl]-4-oxo-3H-phthalazine-1-carbohydrazide IUPAC Name: N'-[3-(4,6-dimethyl-2-methylsulfanylpyrimidin-5-yl)propanoyl]-4-oxo-3H-phthalazine-1-carbohydrazide Traditional Name: N'-[3-[4,6-dimethyl-2-(methylthio)pyrimidin-5-yl]propanoyl]-4-keto-3H-phthalazine-1-carbohydrazide Formula: C19H20N6O3S MolecularWeight: 412.4655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=NC(=N1)SC)C)CCC(=O)NNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C19H20N6O3S/c1-10-12(11(2)21-19(20-10)29-3)8-9-15(26)22-25-18(28)16-13-6-4-5-7-14(13)17(27)24-23-16/h4-7H,8-9H2,1-3H3,(H,22,26)(H,24,27)(H,25,28)