2-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[1-(phenylmethyl)-1,2,3,4-tetrazol-5-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[(1-benzyltetrazol-5-yl)methylsulfanyl]acetic acid CAS Name: 2-[[1-(phenylmethyl)-5-tetrazolyl]methylthio]acetic acid IUPAC Name: 2-[(1-benzyltetrazol-5-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(1-benzyltetrazol-5-yl)methylthio]acetic acid Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=N2)CSCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=N2)CSCC(=O)O

InChI

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