1-(azepan-1-yl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 1-(azepan-1-yl)-2-(1-methyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(1-methyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(1-methyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(1-methyltetrazol-5-yl)thio]ethanone Formula: C10H17N5OS MolecularWeight: 255.33988

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)N2CCCCCC2

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)N2CCCCCC2

InChI

InChI=1S/C10H17N5OS/c1-14-10(11-12-13-14)17-8-9(16)15-6-4-2-3-5-7-15/h2-8H2,1H3