(E)-2-methyl-4-phenylsulfanyl-but-2-enal

Systemtic Name: (E)-2-methyl-4-phenylsulfanyl-but-2-enal Openeye Name: (E)-2-methyl-4-phenylsulfanyl-but-2-enal CAS Name: (E)-2-methyl-4-(phenylthio)-2-butenal IUPAC Name: (E)-2-methyl-4-phenylsulfanylbut-2-enal Traditional Name: (E)-2-methyl-4-(phenylthio)but-2-enal Formula: C11H12OS MolecularWeight: 192.27738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSC1=CC=CC=C1)C=O

Isomeric SMILES

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

InChI

InChI=1S/C11H12OS/c1-10(9-12)7-8-13-11-5-3-2-4-6-11/h2-7,9H,8H2,1H3/b10-7+