2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]ethanamine

Systemtic Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]ethanamine Openeye Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]ethanamine CAS Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]ethanamine IUPAC Name: 2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]ethanamine Traditional Name: 2-[2-(3,4-dimethylphenoxy)ethylthio]ethylamine Formula: C12H19NOS MolecularWeight: 225.35036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSCCN)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSCCN)C

InChI

InChI=1S/C12H19NOS/c1-10-3-4-12(9-11(10)2)14-6-8-15-7-5-13/h3-4,9H,5-8,13H2,1-2H3