2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-N-(2-oxidanyl-5-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-[2-hydroxy-5-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(1,4-dioxo-3H-phthalazin-2-yl)-N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(1,4-diketo-3H-phthalazin-2-yl)-N-(2-hydroxy-5-pyrrolidinosulfonyl-phenyl)acetamide Formula: C20H20N4O6S MolecularWeight: 444.461

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)O)NC(=O)CN3C(=O)C4=CC=CC=C4C(=O)N3

InChI

InChI=1S/C20H20N4O6S/c25-17-8-7-13(31(29,30)23-9-3-4-10-23)11-16(17)21-18(26)12-24-20(28)15-6-2-1-5-14(15)19(27)22-24/h1-2,5-8,11,25H,3-4,9-10,12H2,(H,21,26)(H,22,27)