1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylate

Systemtic Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylate Openeye Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylate CAS Name: 1-[2-(ethylthio)ethyl]-5-benzotriazolecarboxylate IUPAC Name: 1-(2-ethylsulfanylethyl)benzotriazole-5-carboxylate Traditional Name: 1-[2-(ethylthio)ethyl]benzotriazole-5-carboxylate Formula: C11H12N3O2S- MolecularWeight: 250.29688

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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)/p-1