3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-(1-methylsulfonyl-4-piperidyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-(1-methylsulfonyl-4-piperidinyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-(1-methylsulfonylpiperidin-4-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-N-(1-mesyl-4-piperidyl)-3-methyl-phthalazine-1-carboxamide Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C16H20N4O4S/c1-19-16(22)13-6-4-3-5-12(13)14(18-19)15(21)17-11-7-9-20(10-8-11)25(2,23)24/h3-6,11H,7-10H2,1-2H3,(H,17,21)