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

Systemtic Name: 2-[[1-(1,3-benzodioxol-5-yl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[1-(1,3-benzodioxol-5-yl)-5-tetrazolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[1-(1,3-benzodioxol-5-yl)tetrazol-5-yl]thio]-1-piperidino-ethanone Formula: C15H17N5O3S MolecularWeight: 347.39218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NN=NN2C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H17N5O3S/c21-14(19-6-2-1-3-7-19)9-24-15-16-17-18-20(15)11-4-5-12-13(8-11)23-10-22-12/h4-5,8H,1-3,6-7,9-10H2