N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide

Systemtic Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carboxamide Openeye Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3-pentyl-phthalazine-1-carboxamide CAS Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3-pentyl-1-phthalazinecarboxamide IUPAC Name: N-[[4-(methylsulfamoylmethyl)phenyl]methyl]-4-oxo-3-pentylphthalazine-1-carboxamide Traditional Name: 3-amyl-4-keto-N-[4-(methylsulfamoylmethyl)benzyl]phthalazine-1-carboxamide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=CC=C(C=C3)CS(=O)(=O)NC

InChI

InChI=1S/C23H28N4O4S/c1-3-4-7-14-27-23(29)20-9-6-5-8-19(20)21(26-27)22(28)25-15-17-10-12-18(13-11-17)16-32(30,31)24-2/h5-6,8-13,24H,3-4,7,14-16H2,1-2H3,(H,25,28)