N-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C18H18N4O4S MolecularWeight: 386.42492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C)S(=O)(=O)N

InChI

InChI=1S/C18H18N4O4S/c1-10-8-12(27(19,25)26)9-15(11(10)2)20-17(23)16-13-6-4-5-7-14(13)18(24)22(3)21-16/h4-9H,1-3H3,(H,20,23)(H2,19,25,26)