1-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-oxidanyl-propan-2-one

Systemtic Name: 1-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-oxidanyl-propan-2-one Openeye Name: 1-hydroxy-3-(1-methyltetrazol-5-yl)sulfanyl-propan-2-one CAS Name: 1-hydroxy-3-[(1-methyl-5-tetrazolyl)thio]-2-propanone IUPAC Name: 1-hydroxy-3-(1-methyltetrazol-5-yl)sulfanylpropan-2-one Traditional Name: 1-hydroxy-3-[(1-methyltetrazol-5-yl)thio]acetone Formula: C5H8N4O2S MolecularWeight: 188.20762

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)CO

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)CO

InChI

InChI=1S/C5H8N4O2S/c1-9-5(6-7-8-9)12-3-4(11)2-10/h10H,2-3H2,1H3