2-[5-(1,3-benzothiazol-2-ylsulfanyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid

Systemtic Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)-1,2,3,4-tetrazol-1-yl]ethanoic acid Openeye Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)tetrazol-1-yl]acetic acid CAS Name: 2-[5-(1,3-benzothiazol-2-ylthio)-1-tetrazolyl]acetic acid IUPAC Name: 2-[5-(1,3-benzothiazol-2-ylsulfanyl)tetrazol-1-yl]acetic acid Traditional Name: 2-[5-(1,3-benzothiazol-2-ylthio)tetrazol-1-yl]acetic acid Formula: C10H7N5O2S2 MolecularWeight: 293.32488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC3=NN=NN3CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC3=NN=NN3CC(=O)O

InChI

InChI=1S/C10H7N5O2S2/c16-8(17)5-15-9(12-13-14-15)19-10-11-6-3-1-2-4-7(6)18-10/h1-4H,5H2,(H,16,17)