1-[3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]-2-(1,2,3,4-tetrazol-1-yl)ethanone

Systemtic Name: 1-[3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]-2-(1,2,3,4-tetrazol-1-yl)ethanone Openeye Name: 1-[3-(2-methylsulfanylbenzoyl)-1-piperidyl]-2-(tetrazol-1-yl)ethanone CAS Name: 1-[3-[[2-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-2-(1-tetrazolyl)ethanone IUPAC Name: 1-[3-(2-methylsulfanylbenzoyl)piperidin-1-yl]-2-(tetrazol-1-yl)ethanone Traditional Name: 1-[3-[2-(methylthio)benzoyl]piperidino]-2-(tetrazol-1-yl)ethanone Formula: C16H19N5O2S MolecularWeight: 345.41936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CN3C=NN=N3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CN3C=NN=N3

InChI

InChI=1S/C16H19N5O2S/c1-24-14-7-3-2-6-13(14)16(23)12-5-4-8-20(9-12)15(22)10-21-11-17-18-19-21/h2-3,6-7,11-12H,4-5,8-10H2,1H3