3-(3-tert-butylsulfanylpyridin-2-yl)propanoate

Systemtic Name: 3-(3-tert-butylsulfanylpyridin-2-yl)propanoate Openeye Name: 3-(3-tert-butylsulfanyl-2-pyridyl)propanoate CAS Name: 3-[3-(tert-butylthio)-2-pyridinyl]propanoate IUPAC Name: 3-(3-tert-butylsulfanylpyridin-2-yl)propanoate Traditional Name: 3-[3-(tert-butylthio)-2-pyridyl]propionate Formula: C12H16NO2S- MolecularWeight: 238.32594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=C(N=CC=C1)CCC(=O)[O-]

Isomeric SMILES

CC(C)(C)SC1=C(N=CC=C1)CCC(=O)[O-]

InChI

InChI=1S/C12H17NO2S/c1-12(2,3)16-10-5-4-8-13-9(10)6-7-11(14)15/h4-5,8H,6-7H2,1-3H3,(H,14,15)/p-1