3-methyl-N'-(1-methylsulfonylpiperidin-2-yl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-methyl-N'-(1-methylsulfonylpiperidin-2-yl)carbonyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-methyl-N'-(1-methylsulfonylpiperidine-2-carbonyl)-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-methyl-N'-[(1-methylsulfonyl-2-piperidinyl)-oxomethyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-methyl-N'-(1-methylsulfonylpiperidine-2-carbonyl)-4-oxophthalazine-1-carbohydrazide Traditional Name: 4-keto-N'-(1-mesylpipecoloyl)-3-methyl-phthalazine-1-carbohydrazide Formula: C17H21N5O5S MolecularWeight: 407.44414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CCCCN3S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CCCCN3S(=O)(=O)C

InChI

InChI=1S/C17H21N5O5S/c1-21-17(25)12-8-4-3-7-11(12)14(20-21)16(24)19-18-15(23)13-9-5-6-10-22(13)28(2,26)27/h3-4,7-8,13H,5-6,9-10H2,1-2H3,(H,18,23)(H,19,24)