2-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(1-phenethyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoic acid Openeye Name: 2-(1-phenethyltetrazol-5-yl)sulfanylacetic acid CAS Name: 2-[(1-phenethyl-5-tetrazolyl)thio]acetic acid IUPAC Name: 2-(1-phenethyltetrazol-5-yl)sulfanylacetic acid Traditional Name: 2-[(1-phenethyltetrazol-5-yl)thio]acetic acid Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=NN=N2)SCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=NN=N2)SCC(=O)O

InChI

InChI=1S/C11H12N4O2S/c16-10(17)8-18-11-12-13-14-15(11)7-6-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,16,17)