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

Systemtic Name: 2-[(1-butan-2-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoic acid Openeye Name: 2-(1-sec-butyltetrazol-5-yl)sulfanylacetic acid CAS Name: 2-[(1-butan-2-yl-5-tetrazolyl)thio]acetic acid IUPAC Name: 2-(1-butan-2-yltetrazol-5-yl)sulfanylacetic acid Traditional Name: 2-[(1-sec-butyltetrazol-5-yl)thio]acetic acid Formula: C7H12N4O2S MolecularWeight: 216.26078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=NN=N1)SCC(=O)O

Isomeric SMILES

CCC(C)N1C(=NN=N1)SCC(=O)O

InChI

InChI=1S/C7H12N4O2S/c1-3-5(2)11-7(8-9-10-11)14-4-6(12)13/h5H,3-4H2,1-2H3,(H,12,13)