4-cyclobutyl-3-(4-methylsulfanylphenyl)-4-oxidanylidene-butanal

Systemtic Name: 4-cyclobutyl-3-(4-methylsulfanylphenyl)-4-oxidanylidene-butanal Openeye Name: 4-cyclobutyl-3-(4-methylsulfanylphenyl)-4-oxo-butanal CAS Name: 4-cyclobutyl-3-[4-(methylthio)phenyl]-4-oxobutanal IUPAC Name: 4-cyclobutyl-3-(4-methylsulfanylphenyl)-4-oxobutanal Traditional Name: 4-cyclobutyl-4-keto-3-[4-(methylthio)phenyl]butyraldehyde Formula: C15H18O2S MolecularWeight: 262.36722

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(CC=O)C(=O)C2CCC2

Isomeric SMILES

CSC1=CC=C(C=C1)C(CC=O)C(=O)C2CCC2

InChI

InChI=1S/C15H18O2S/c1-18-13-7-5-11(6-8-13)14(9-10-16)15(17)12-3-2-4-12/h5-8,10,12,14H,2-4,9H2,1H3