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

Systemtic Name: 2-[[1-(4-dimethylaminophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanoic acid Openeye Name: 2-[1-(4-dimethylaminophenyl)tetrazol-5-yl]sulfanylacetic acid CAS Name: 2-[[1-(4-dimethylaminophenyl)-5-tetrazolyl]thio]acetic acid IUPAC Name: 2-[1-(4-dimethylaminophenyl)tetrazol-5-yl]sulfanylacetic acid Traditional Name: 2-[[1-(4-dimethylaminophenyl)tetrazol-5-yl]thio]acetic acid Formula: C11H13N5O2S MolecularWeight: 279.31822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)O

InChI

InChI=1S/C11H13N5O2S/c1-15(2)8-3-5-9(6-4-8)16-11(12-13-14-16)19-7-10(17)18/h3-6H,7H2,1-2H3,(H,17,18)