1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylic acid

Systemtic Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylic acid Openeye Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylic acid CAS Name: 1-[2-(ethylthio)ethyl]-5-benzotriazolecarboxylic acid IUPAC Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylic acid Traditional Name: 1-[2-(ethylthio)ethyl]benzotriazole-5-carboxylic acid Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCN1C2=C(C=C(C=C2)C(=O)O)N=N1

Isomeric SMILES

CCSCCN1C2=C(C=C(C=C2)C(=O)O)N=N1

InChI

InChI=1S/C11H13N3O2S/c1-2-17-6-5-14-10-4-3-8(11(15)16)7-9(10)12-13-14/h3-4,7H,2,5-6H2,1H3,(H,15,16)