2-(4-ethylsulfanyl-3,5-dimethoxy-phenyl)ethanenitrile

Systemtic Name: 2-(4-ethylsulfanyl-3,5-dimethoxy-phenyl)ethanenitrile Openeye Name: 2-(4-ethylsulfanyl-3,5-dimethoxy-phenyl)acetonitrile CAS Name: 2-[4-(ethylthio)-3,5-dimethoxyphenyl]acetonitrile IUPAC Name: 2-(4-ethylsulfanyl-3,5-dimethoxyphenyl)acetonitrile Traditional Name: 2-[4-(ethylthio)-3,5-dimethoxy-phenyl]acetonitrile Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=C(C=C1OC)CC#N)OC

Isomeric SMILES

CCSC1=C(C=C(C=C1OC)CC#N)OC

InChI

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