sodium 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]ethanoate

Systemtic Name: sodium 2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]ethanoate Openeye Name: sodium 2-[(1-phenyltetrazol-5-yl)methylsulfanyl]acetate CAS Name: sodium 2-[(1-phenyl-5-tetrazolyl)methylthio]acetate IUPAC Name: sodium 2-[(1-phenyltetrazol-5-yl)methylsulfanyl]acetate Traditional Name: sodium 2-[(1-phenyltetrazol-5-yl)methylthio]acetate Formula: C10H9N4NaO2S MolecularWeight: 272.25883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)CSCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)CSCC(=O)[O-].[Na+]

InChI

InChI=1S/C10H10N4O2S.Na/c15-10(16)7-17-6-9-11-12-13-14(9)8-4-2-1-3-5-8;/h1-5H,6-7H2,(H,15,16);/q;+1/p-1