3-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione

Systemtic Name: 3-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2H-phthalazine-1,4-dione Openeye Name: 3-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-2H-phthalazine-1,4-dione CAS Name: 3-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxoethyl]-2H-phthalazine-1,4-dione Traditional Name: 3-[2-keto-2-(4-mesylpiperazino)ethyl]-2H-phthalazine-1,4-quinone Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C15H18N4O5S/c1-25(23,24)18-8-6-17(7-9-18)13(20)10-19-15(22)12-5-3-2-4-11(12)14(21)16-19/h2-5H,6-10H2,1H3,(H,16,21)