2-(3-ethoxy-5-methoxy-4-methylsulfanyl-phenyl)ethanenitrile

Systemtic Name: 2-(3-ethoxy-5-methoxy-4-methylsulfanyl-phenyl)ethanenitrile Openeye Name: 2-(3-ethoxy-5-methoxy-4-methylsulfanyl-phenyl)acetonitrile CAS Name: 2-[3-ethoxy-5-methoxy-4-(methylthio)phenyl]acetonitrile IUPAC Name: 2-(3-ethoxy-5-methoxy-4-methylsulfanylphenyl)acetonitrile Traditional Name: 2-[3-ethoxy-5-methoxy-4-(methylthio)phenyl]acetonitrile Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1SC)OC)CC#N

Isomeric SMILES

CCOC1=CC(=CC(=C1SC)OC)CC#N

InChI

InChI=1S/C12H15NO2S/c1-4-15-11-8-9(5-6-13)7-10(14-2)12(11)16-3/h7-8H,4-5H2,1-3H3