3-methyl-2-(phenylsulfanylmethyl)pent-4-enal

Systemtic Name: 3-methyl-2-(phenylsulfanylmethyl)pent-4-enal Openeye Name: 3-methyl-2-(phenylsulfanylmethyl)pent-4-enal CAS Name: 3-methyl-2-[(phenylthio)methyl]-4-pentenal IUPAC Name: 3-methyl-2-(phenylsulfanylmethyl)pent-4-enal Traditional Name: 3-methyl-2-[(phenylthio)methyl]pent-4-enal Formula: C13H16OS MolecularWeight: 220.33054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16OS/c1-3-11(2)12(9-14)10-15-13-7-5-4-6-8-13/h3-9,11-12H,1,10H2,2H3