N-[3-[7-methyl-2-(oxan-4-ylmethylamino)-1-oxidanylidene-3H-isoindol-5-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[7-methyl-2-(oxan-4-ylmethylamino)-1-oxidanylidene-3H-isoindol-5-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[7-methyl-1-oxo-2-(tetrahydropyran-4-ylmethylamino)isoindolin-5-yl]phenyl]methanesulfonamide CAS Name: N-[3-[7-methyl-2-(4-oxanylmethylamino)-1-oxo-3H-isoindol-5-yl]phenyl]methanesulfonamide IUPAC Name: N-[3-[7-methyl-2-(oxan-4-ylmethylamino)-1-oxo-3H-isoindol-5-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[1-keto-7-methyl-2-(tetrahydropyran-4-ylmethylamino)isoindolin-5-yl]phenyl]methanesulfonamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)N(C2)NCC3CCOCC3)C4=CC(=CC=C4)NS(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)N(C2)NCC3CCOCC3)C4=CC(=CC=C4)NS(=O)(=O)C

InChI

InChI=1S/C22H27N3O4S/c1-15-10-18(17-4-3-5-20(12-17)24-30(2,27)28)11-19-14-25(22(26)21(15)19)23-13-16-6-8-29-9-7-16/h3-5,10-12,16,23-24H,6-9,13-14H2,1-2H3