N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[2-(4-fluoranylphenoxy)-5-morpholin-4-ylsulfonyl-phenyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(4-fluorophenoxy)-5-(4-morpholinylsulfonyl)phenyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(4-fluorophenoxy)-5-morpholin-4-ylsulfonylphenyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(4-fluorophenoxy)-5-morpholinosulfonyl-phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C26H23FN4O6S MolecularWeight: 538.547423

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC5=CC=C(C=C5)F

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC5=CC=C(C=C5)F

InChI

InChI=1S/C26H23FN4O6S/c1-30-26(33)21-5-3-2-4-20(21)24(29-30)25(32)28-22-16-19(38(34,35)31-12-14-36-15-13-31)10-11-23(22)37-18-8-6-17(27)7-9-18/h2-11,16H,12-15H2,1H3,(H,28,32)