3-(pyrazin-2-ylmethylsulfanyl)propanoic acid

Systemtic Name: 3-(pyrazin-2-ylmethylsulfanyl)propanoic acid Openeye Name: 3-(pyrazin-2-ylmethylsulfanyl)propanoic acid CAS Name: 3-(2-pyrazinylmethylthio)propanoic acid IUPAC Name: 3-(pyrazin-2-ylmethylsulfanyl)propanoic acid Traditional Name: 3-(pyrazin-2-ylmethylthio)propionic acid Formula: C8H10N2O2S MolecularWeight: 198.2422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=N1)CSCCC(=O)O

Isomeric SMILES

C1=CN=C(C=N1)CSCCC(=O)O

InChI

InChI=1S/C8H10N2O2S/c11-8(12)1-4-13-6-7-5-9-2-3-10-7/h2-3,5H,1,4,6H2,(H,11,12)