2-(diethylamino)-2-(4-methylsulfanylphenyl)ethanoic acid

Systemtic Name: 2-(diethylamino)-2-(4-methylsulfanylphenyl)ethanoic acid Openeye Name: 2-(diethylamino)-2-(4-methylsulfanylphenyl)acetic acid CAS Name: 2-(diethylamino)-2-[4-(methylthio)phenyl]acetic acid IUPAC Name: 2-(diethylamino)-2-(4-methylsulfanylphenyl)acetic acid Traditional Name: 2-(diethylamino)-2-[4-(methylthio)phenyl]acetic acid Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C1=CC=C(C=C1)SC)C(=O)O

Isomeric SMILES

CCN(CC)C(C1=CC=C(C=C1)SC)C(=O)O

InChI

InChI=1S/C13H19NO2S/c1-4-14(5-2)12(13(15)16)10-6-8-11(17-3)9-7-10/h6-9,12H,4-5H2,1-3H3,(H,15,16)