4-oxidanylidene-3-[2-oxidanylidene-2-[[3-(propan-2-ylsulfamoyl)phenyl]methylamino]ethyl]phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[[3-(propan-2-ylsulfamoyl)phenyl]methylamino]ethyl]phthalazin-1-olate Openeye Name: 3-[2-[[3-(isopropylsulfamoyl)phenyl]methylamino]-2-oxo-ethyl]-4-oxo-phthalazin-1-olate CAS Name: 4-oxo-3-[2-oxo-2-[[3-(propan-2-ylsulfamoyl)phenyl]methylamino]ethyl]-1-phthalazinolate IUPAC Name: 4-oxo-3-[2-oxo-2-[[3-(propan-2-ylsulfamoyl)phenyl]methylamino]ethyl]phthalazin-1-olate Traditional Name: 3-[2-[[3-(isopropylsulfamoyl)benzyl]amino]-2-keto-ethyl]-4-keto-phthalazin-1-olate Formula: C20H21N4O5S- MolecularWeight: 429.46954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC=CC(=C1)CNC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C20H22N4O5S/c1-13(2)23-30(28,29)15-7-5-6-14(10-15)11-21-18(25)12-24-20(27)17-9-4-3-8-16(17)19(26)22-24/h3-10,13,23H,11-12H2,1-2H3,(H,21,25)(H,22,26)/p-1