N-[3-methoxy-4-(methylsulfonylamino)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[3-methoxy-4-(methylsulfonylamino)phenyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[4-(methanesulfonamido)-3-methoxy-phenyl]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[4-(methanesulfonamido)-3-methoxyphenyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[4-(methanesulfonamido)-3-methoxyphenyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[4-(methanesulfonamido)-3-methoxy-phenyl]-3H-phthalazine-1-carboxamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)NS(=O)(=O)C

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=NNC(=O)C3=CC=CC=C32)NS(=O)(=O)C

InChI

InChI=1S/C17H16N4O5S/c1-26-14-9-10(7-8-13(14)21-27(2,24)25)18-17(23)15-11-5-3-4-6-12(11)16(22)20-19-15/h3-9,21H,1-2H3,(H,18,23)(H,20,22)