3-(2-ethanoylphenyl)sulfanyl-2-methyl-propanal

Systemtic Name: 3-(2-ethanoylphenyl)sulfanyl-2-methyl-propanal Openeye Name: 3-(2-acetylphenyl)sulfanyl-2-methyl-propanal CAS Name: 3-[(2-acetylphenyl)thio]-2-methylpropanal IUPAC Name: 3-(2-acetylphenyl)sulfanyl-2-methylpropanal Traditional Name: 3-[(2-acetylphenyl)thio]-2-methyl-propionaldehyde Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=CC=CC=C1C(=O)C)C=O

Isomeric SMILES

CC(CSC1=CC=CC=C1C(=O)C)C=O

InChI

InChI=1S/C12H14O2S/c1-9(7-13)8-15-12-6-4-3-5-11(12)10(2)14/h3-7,9H,8H2,1-2H3