2-(3-methyl-4-propan-2-ylsulfanyl-phenyl)-2-oxidanylidene-ethanal

Systemtic Name: 2-(3-methyl-4-propan-2-ylsulfanyl-phenyl)-2-oxidanylidene-ethanal Openeye Name: 2-(4-isopropylsulfanyl-3-methyl-phenyl)-2-oxo-acetaldehyde CAS Name: 2-[3-methyl-4-(propan-2-ylthio)phenyl]-2-oxoacetaldehyde IUPAC Name: 2-(3-methyl-4-propan-2-ylsulfanylphenyl)-2-oxoacetaldehyde Traditional Name: 2-[4-(isopropylthio)-3-methyl-phenyl]-2-keto-acetaldehyde Formula: C12H14O2S MolecularWeight: 222.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)C=O)SC(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)C=O)SC(C)C

InChI

InChI=1S/C12H14O2S/c1-8(2)15-12-5-4-10(6-9(12)3)11(14)7-13/h4-8H,1-3H3