4-[3-[2-hydroxyethyl(3-methylsulfanylpropyl)amino]propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[2-hydroxyethyl(3-methylsulfanylpropyl)amino]propoxy]benzenecarbonitrile Openeye Name: 4-[3-[2-hydroxyethyl(3-methylsulfanylpropyl)amino]propoxy]benzonitrile CAS Name: 4-[3-[2-hydroxyethyl-[3-(methylthio)propyl]amino]propoxy]benzonitrile IUPAC Name: 4-[3-[2-hydroxyethyl(3-methylsulfanylpropyl)amino]propoxy]benzonitrile Traditional Name: 4-[3-[2-hydroxyethyl-[3-(methylthio)propyl]amino]propoxy]benzonitrile Formula: C16H24N2O2S MolecularWeight: 308.43896

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCN(CCCOC1=CC=C(C=C1)C#N)CCO

Isomeric SMILES

CSCCCN(CCCOC1=CC=C(C=C1)C#N)CCO

InChI

InChI=1S/C16H24N2O2S/c1-21-13-3-9-18(10-11-19)8-2-12-20-16-6-4-15(14-17)5-7-16/h4-7,19H,2-3,8-13H2,1H3