3-(2-methylpropyl)-N-(4-methyl-3-sulfamoyl-phenyl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(2-methylpropyl)-N-(4-methyl-3-sulfamoyl-phenyl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-(4-methyl-3-sulfamoyl-phenyl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(2-methylpropyl)-N-(4-methyl-3-sulfamoylphenyl)-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(2-methylpropyl)-N-(4-methyl-3-sulfamoylphenyl)-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-(4-methyl-3-sulfamoyl-phenyl)phthalazine-1-carboxamide Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C)S(=O)(=O)N

InChI

InChI=1S/C20H22N4O4S/c1-12(2)11-24-20(26)16-7-5-4-6-15(16)18(23-24)19(25)22-14-9-8-13(3)17(10-14)29(21,27)28/h4-10,12H,11H2,1-3H3,(H,22,25)(H2,21,27,28)