2-[[1-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[[1-(3-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[1-(m-tolyl)tetrazol-5-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[1-(3-methylphenyl)-5-tetrazolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-(3-methylphenyl)tetrazol-5-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[1-(m-tolyl)tetrazol-5-yl]thio]-1-piperidino-ethanone Formula: C15H19N5OS MolecularWeight: 317.40926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=N2)SCC(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=N2)SCC(=O)N3CCCCC3

InChI

InChI=1S/C15H19N5OS/c1-12-6-5-7-13(10-12)20-15(16-17-18-20)22-11-14(21)19-8-3-2-4-9-19/h5-7,10H,2-4,8-9,11H2,1H3