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

Systemtic Name: N-[3-methoxy-4-(methylsulfonylamino)phenyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[4-(methanesulfonamido)-3-methoxy-phenyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[4-(methanesulfonamido)-3-methoxyphenyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[4-(methanesulfonamido)-3-methoxyphenyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[4-(methanesulfonamido)-3-methoxy-phenyl]phthalazine-1-carboxamide Formula: C22H26N4O5S MolecularWeight: 458.53064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)NS(=O)(=O)C)OC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC(=C(C=C3)NS(=O)(=O)C)OC

InChI

InChI=1S/C22H26N4O5S/c1-4-5-8-13-26-22(28)17-10-7-6-9-16(17)20(24-26)21(27)23-15-11-12-18(19(14-15)31-2)25-32(3,29)30/h6-7,9-12,14,25H,4-5,8,13H2,1-3H3,(H,23,27)