N-(5-methyl-1,2-oxazol-3-yl)-2-[[(1S)-3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[[(1S)-3-oxidanylidene-2-(phenylmethyl)-1H-isoindol-1-yl]sulfanyl]ethanamide Openeye Name: 2-[(1S)-2-benzyl-3-oxo-isoindolin-1-yl]sulfanyl-N-(5-methylisoxazol-3-yl)acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[(1S)-3-oxo-2-(phenylmethyl)-1H-isoindol-1-yl]thio]acetamide IUPAC Name: 2-[[(1S)-2-benzyl-3-oxo-1H-isoindol-1-yl]sulfanyl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide Traditional Name: 2-[[(1S)-2-benzyl-3-keto-isoindolin-1-yl]thio]-N-(5-methylisoxazol-3-yl)acetamide Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CS[C@H]2C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C21H19N3O3S/c1-14-11-18(23-27-14)22-19(25)13-28-21-17-10-6-5-9-16(17)20(26)24(21)12-15-7-3-2-4-8-15/h2-11,21H,12-13H2,1H3,(H,22,23,25)/t21-/m0/s1