2-ethyl-5-[4-methylsulfanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-4-oxidanylidene-pentanal

Systemtic Name: 2-ethyl-5-[4-methylsulfanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-4-oxidanylidene-pentanal Openeye Name: 2-ethyl-5-(4-methylsulfanyl-1,3-dioxo-isoindolin-2-yl)-4-oxo-pentanal CAS Name: 2-ethyl-5-[4-(methylthio)-1,3-dioxo-2-isoindolyl]-4-oxopentanal IUPAC Name: 2-ethyl-5-(4-methylsulfanyl-1,3-dioxoisoindol-2-yl)-4-oxopentanal Traditional Name: 5-[1,3-diketo-4-(methylthio)isoindolin-2-yl]-2-ethyl-4-keto-valeraldehyde Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)SC)C=O

Isomeric SMILES

CCC(CC(=O)CN1C(=O)C2=C(C1=O)C(=CC=C2)SC)C=O

InChI

InChI=1S/C16H17NO4S/c1-3-10(9-18)7-11(19)8-17-15(20)12-5-4-6-13(22-2)14(12)16(17)21/h4-6,9-10H,3,7-8H2,1-2H3