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

Systemtic Name: 1-[3-(2-methylsulfanylphenyl)carbonylpiperidin-1-yl]-3-(1,2,3,4-tetrazol-1-yl)propan-1-one Openeye Name: 1-[3-(2-methylsulfanylbenzoyl)-1-piperidyl]-3-(tetrazol-1-yl)propan-1-one CAS Name: 1-[3-[[2-(methylthio)phenyl]-oxomethyl]-1-piperidinyl]-3-(1-tetrazolyl)-1-propanone IUPAC Name: 1-[3-(2-methylsulfanylbenzoyl)piperidin-1-yl]-3-(tetrazol-1-yl)propan-1-one Traditional Name: 1-[3-[2-(methylthio)benzoyl]piperidino]-3-(tetrazol-1-yl)propan-1-one Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CCN3C=NN=N3

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)C(=O)CCN3C=NN=N3

InChI

InChI=1S/C17H21N5O2S/c1-25-15-7-3-2-6-14(15)17(24)13-5-4-9-21(11-13)16(23)8-10-22-12-18-19-20-22/h2-3,6-7,12-13H,4-5,8-11H2,1H3