3-butyl-4-oxidanylidene-N-[2-(4-sulfamoylphenyl)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-butyl-4-oxidanylidene-N-[2-(4-sulfamoylphenyl)ethyl]phthalazine-1-carboxamide Openeye Name: 3-butyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]phthalazine-1-carboxamide CAS Name: 3-butyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-butyl-4-oxo-N-[2-(4-sulfamoylphenyl)ethyl]phthalazine-1-carboxamide Traditional Name: 3-butyl-4-keto-N-[2-(4-sulfamoylphenyl)ethyl]phthalazine-1-carboxamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H24N4O4S/c1-2-3-14-25-21(27)18-7-5-4-6-17(18)19(24-25)20(26)23-13-12-15-8-10-16(11-9-15)30(22,28)29/h4-11H,2-3,12-14H2,1H3,(H,23,26)(H2,22,28,29)