N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-(methylsulfamoylmethyl)benzyl]-3H-phthalazine-1-carboxamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O4S/c1-19-27(25,26)11-13-8-6-12(7-9-13)10-20-18(24)16-14-4-2-3-5-15(14)17(23)22-21-16/h2-9,19H,10-11H2,1H3,(H,20,24)(H,22,23)