N-[[2-(methylsulfonylamino)phenyl]methyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[[2-(methylsulfonylamino)phenyl]methyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[[2-(methanesulfonamido)phenyl]methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[[2-(methanesulfonamido)phenyl]methyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[[2-(methanesulfonamido)phenyl]methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-4-keto-N-[2-(methanesulfonamido)benzyl]phthalazine-1-carboxamide Formula: C24H22N4O4S MolecularWeight: 462.52088

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC=C1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4

InChI

InChI=1S/C24H22N4O4S/c1-33(31,32)27-21-14-8-5-11-18(21)15-25-23(29)22-19-12-6-7-13-20(19)24(30)28(26-22)16-17-9-3-2-4-10-17/h2-14,27H,15-16H2,1H3,(H,25,29)