4-methyl-2-[[2-(6-methyl-4-oxidanylidene-2-sulfanyl-cyclohexa-1,5-dien-1-yl)phenyl]methyl]thiomorpholin-3-one

Systemtic Name: 4-methyl-2-[[2-(6-methyl-4-oxidanylidene-2-sulfanyl-cyclohexa-1,5-dien-1-yl)phenyl]methyl]thiomorpholin-3-one Openeye Name: 4-methyl-2-[[2-(6-methyl-4-oxo-2-sulfanyl-cyclohexa-1,5-dien-1-yl)phenyl]methyl]thiomorpholin-3-one CAS Name: 2-[[2-(2-mercapto-6-methyl-4-oxo-1-cyclohexa-1,5-dienyl)phenyl]methyl]-4-methyl-3-thiomorpholinone IUPAC Name: 4-methyl-2-[[2-(6-methyl-4-oxo-2-sulfanylcyclohexa-1,5-dien-1-yl)phenyl]methyl]thiomorpholin-3-one Traditional Name: 2-[2-(4-keto-2-mercapto-6-methyl-cyclohexa-1,5-dien-1-yl)benzyl]-4-methyl-thiomorpholin-3-one Formula: C19H21NO2S2 MolecularWeight: 359.50554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(=C1C2=CC=CC=C2CC3C(=O)N(CCS3)C)S

Isomeric SMILES

CC1=CC(=O)CC(=C1C2=CC=CC=C2CC3C(=O)N(CCS3)C)S

InChI

InChI=1S/C19H21NO2S2/c1-12-9-14(21)11-16(23)18(12)15-6-4-3-5-13(15)10-17-19(22)20(2)7-8-24-17/h3-6,9,17,23H,7-8,10-11H2,1-2H3