2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoic acid

Systemtic Name: 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoic acid Openeye Name: 2-(1-phenyltetrazol-5-yl)sulfanylpropanoic acid CAS Name: 2-[(1-phenyl-5-tetrazolyl)thio]propanoic acid IUPAC Name: 2-(1-phenyltetrazol-5-yl)sulfanylpropanoic acid Traditional Name: 2-[(1-phenyltetrazol-5-yl)thio]propionic acid Formula: C10H10N4O2S MolecularWeight: 250.277

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)O)SC1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C10H10N4O2S/c1-7(9(15)16)17-10-11-12-13-14(10)8-5-3-2-4-6-8/h2-7H,1H3,(H,15,16)