4-oxidanylidene-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Openeye Name: N-[[4-(isopropylsulfamoylmethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-[[4-(propan-2-ylsulfamoylmethyl)phenyl]methyl]-3H-phthalazine-1-carboxamide Traditional Name: N-[4-(isopropylsulfamoylmethyl)benzyl]-4-keto-3H-phthalazine-1-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=C(C=C1)CNC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H22N4O4S/c1-13(2)24-29(27,28)12-15-9-7-14(8-10-15)11-21-20(26)18-16-5-3-4-6-17(16)19(25)23-22-18/h3-10,13,24H,11-12H2,1-2H3,(H,21,26)(H,23,25)