4-[[6-[4-(1H-imidazol-5-yl)but-1-ynyl]-3-oxidanylidene-1H-isoindol-2-yl]methyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-[[6-[4-(1H-imidazol-5-yl)but-1-ynyl]-3-oxidanylidene-1H-isoindol-2-yl]methyl]-N-methyl-benzenesulfonamide Openeye Name: 4-[[5-[4-(1H-imidazol-5-yl)but-1-ynyl]-1-oxo-isoindolin-2-yl]methyl]-N-methyl-benzenesulfonamide CAS Name: 4-[[6-[4-(1H-imidazol-5-yl)but-1-ynyl]-3-oxo-1H-isoindol-2-yl]methyl]-N-methylbenzenesulfonamide IUPAC Name: 4-[[6-[4-(1H-imidazol-5-yl)but-1-ynyl]-3-oxo-1H-isoindol-2-yl]methyl]-N-methylbenzenesulfonamide Traditional Name: 4-[[5-[4-(1H-imidazol-5-yl)but-1-ynyl]-1-keto-isoindolin-2-yl]methyl]-N-methyl-benzenesulfonamide Formula: C23H22N4O3S MolecularWeight: 434.51078

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)CN2CC3=C(C2=O)C=CC(=C3)C#CCCC4=CN=CN4

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)CN2CC3=C(C2=O)C=CC(=C3)C#CCCC4=CN=CN4

InChI

InChI=1S/C23H22N4O3S/c1-24-31(29,30)21-9-6-18(7-10-21)14-27-15-19-12-17(8-11-22(19)23(27)28)4-2-3-5-20-13-25-16-26-20/h6-13,16,24H,3,5,14-15H2,1H3,(H,25,26)