3-methyl-N'-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-methyl-N'-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-methyl-4-oxo-N'-[1-(p-tolylsulfonyl)piperidine-2-carbonyl]phthalazine-1-carbohydrazide CAS Name: 3-methyl-N'-[[1-(4-methylphenyl)sulfonyl-2-piperidinyl]-oxomethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-methyl-N'-[1-(4-methylphenyl)sulfonylpiperidine-2-carbonyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 4-keto-3-methyl-N'-(1-tosylpipecoloyl)phthalazine-1-carbohydrazide Formula: C23H25N5O5S MolecularWeight: 483.5401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)NNC(=O)C3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C23H25N5O5S/c1-15-10-12-16(13-11-15)34(32,33)28-14-6-5-9-19(28)21(29)24-25-22(30)20-17-7-3-4-8-18(17)23(31)27(2)26-20/h3-4,7-8,10-13,19H,5-6,9,14H2,1-2H3,(H,24,29)(H,25,30)