1-(2,6-dimethylpiperidin-1-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone

Systemtic Name: 1-(2,6-dimethylpiperidin-1-yl)-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanone Openeye Name: 1-(2,6-dimethyl-1-piperidyl)-2-(1-phenyltetrazol-5-yl)sulfanyl-ethanone CAS Name: 1-(2,6-dimethyl-1-piperidinyl)-2-[(1-phenyl-5-tetrazolyl)thio]ethanone IUPAC Name: 1-(2,6-dimethylpiperidin-1-yl)-2-(1-phenyltetrazol-5-yl)sulfanylethanone Traditional Name: 1-(2,6-dimethylpiperidino)-2-[(1-phenyltetrazol-5-yl)thio]ethanone Formula: C16H21N5OS MolecularWeight: 331.43584

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NN=NN2C3=CC=CC=C3)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NN=NN2C3=CC=CC=C3)C

InChI

InChI=1S/C16H21N5OS/c1-12-7-6-8-13(2)20(12)15(22)11-23-16-17-18-19-21(16)14-9-4-3-5-10-14/h3-5,9-10,12-13H,6-8,11H2,1-2H3