N-(4-methylsulfonylphenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(4-methylsulfonylphenyl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(4-methylsulfonylphenyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(4-methylsulfonylphenyl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(4-methylsulfonylphenyl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-(4-mesylphenyl)-3H-phthalazine-1-carboxamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C16H13N3O4S/c1-24(22,23)11-8-6-10(7-9-11)17-16(21)14-12-4-2-3-5-13(12)15(20)19-18-14/h2-9H,1H3,(H,17,21)(H,19,20)