2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]propanoic acid

Systemtic Name: 2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]propanoic acid Openeye Name: 2-[(1-propyltetrazol-5-yl)methylsulfanyl]propanoic acid CAS Name: 2-[(1-propyl-5-tetrazolyl)methylthio]propanoic acid IUPAC Name: 2-[(1-propyltetrazol-5-yl)methylsulfanyl]propanoic acid Traditional Name: 2-[(1-propyltetrazol-5-yl)methylthio]propionic acid Formula: C8H14N4O2S MolecularWeight: 230.28736

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC(C)C(=O)O

Isomeric SMILES

CCCN1C(=NN=N1)CSC(C)C(=O)O

InChI

InChI=1S/C8H14N4O2S/c1-3-4-12-7(9-10-11-12)5-15-6(2)8(13)14/h6H,3-5H2,1-2H3,(H,13,14)