3-methyl-N'-[3-(4-methylphenyl)sulfanylpropanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-methyl-N'-[3-(4-methylphenyl)sulfanylpropanoyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-methyl-4-oxo-N'-[3-(p-tolylsulfanyl)propanoyl]phthalazine-1-carbohydrazide CAS Name: 3-methyl-N'-[3-[(4-methylphenyl)thio]-1-oxopropyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-methyl-N'-[3-(4-methylphenyl)sulfanylpropanoyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 4-keto-3-methyl-N'-[3-(p-tolylthio)propanoyl]phthalazine-1-carbohydrazide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C20H20N4O3S/c1-13-7-9-14(10-8-13)28-12-11-17(25)21-22-19(26)18-15-5-3-4-6-16(15)20(27)24(2)23-18/h3-10H,11-12H2,1-2H3,(H,21,25)(H,22,26)