4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 4-methylsulfonyl-2-(3-oxidanylidene-1H-isoindol-2-yl)-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 4-methylsulfonyl-2-(1-oxoisoindolin-2-yl)-N-(3-pyridylmethyl)butanamide CAS Name: 4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)-N-(3-pyridinylmethyl)butanamide IUPAC Name: 4-methylsulfonyl-2-(3-oxo-1H-isoindol-2-yl)-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 2-(1-ketoisoindolin-2-yl)-4-mesyl-N-(3-pyridylmethyl)butyramide Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)CCC(C(=O)NCC1=CN=CC=C1)N2CC3=CC=CC=C3C2=O

Isomeric SMILES

CS(=O)(=O)CCC(C(=O)NCC1=CN=CC=C1)N2CC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H21N3O4S/c1-27(25,26)10-8-17(18(23)21-12-14-5-4-9-20-11-14)22-13-15-6-2-3-7-16(15)19(22)24/h2-7,9,11,17H,8,10,12-13H2,1H3,(H,21,23)