5-methyl-2-(4-methylsulfanyl-3-oxidanylidene-butyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 5-methyl-2-(4-methylsulfanyl-3-oxidanylidene-butyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 5-methyl-2-(4-methylsulfanyl-3-oxo-butyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 5-methyl-2-[4-(methylthio)-3-oxobutyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 5-methyl-2-(4-methylsulfanyl-3-oxobutyl)-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[3-keto-4-(methylthio)butyl]-5-methyl-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2C(C1)C(=O)N(C2=O)CCC(=O)CSC

Isomeric SMILES

CC1=CCC2C(C1)C(=O)N(C2=O)CCC(=O)CSC

InChI

InChI=1S/C14H19NO3S/c1-9-3-4-11-12(7-9)14(18)15(13(11)17)6-5-10(16)8-19-2/h3,11-12H,4-8H2,1-2H3