(2S)-2-(pyridin-4-ylmethylsulfanyl)propanoic acid

Systemtic Name: (2S)-2-(pyridin-4-ylmethylsulfanyl)propanoic acid Openeye Name: (2S)-2-(4-pyridylmethylsulfanyl)propanoic acid CAS Name: (2S)-2-(pyridin-4-ylmethylthio)propanoic acid IUPAC Name: (2S)-2-(pyridin-4-ylmethylsulfanyl)propanoic acid Traditional Name: (2S)-2-(4-pyridylmethylthio)propionic acid Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SCC1=CC=NC=C1

Isomeric SMILES

C[C@@H](C(=O)O)SCC1=CC=NC=C1

InChI

InChI=1S/C9H11NO2S/c1-7(9(11)12)13-6-8-2-4-10-5-3-8/h2-5,7H,6H2,1H3,(H,11,12)/t7-/m0/s1