potassium 2-[[3-(5-piperidin-1-ylcarbonylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]carbamoyl]benzenesulfonate

Systemtic Name: potassium 2-[[3-(5-piperidin-1-ylcarbonylsulfanyl-1,2,3,4-tetrazol-1-yl)phenyl]carbamoyl]benzenesulfonate Openeye Name: potassium 2-[[3-[5-(piperidine-1-carbonylsulfanyl)tetrazol-1-yl]phenyl]carbamoyl]benzenesulfonate CAS Name: potassium 2-[oxo-[3-[5-[[oxo(1-piperidinyl)methyl]thio]-1-tetrazolyl]anilino]methyl]benzenesulfonate IUPAC Name: potassium 2-[[3-[5-(piperidine-1-carbonylsulfanyl)tetrazol-1-yl]phenyl]carbamoyl]benzenesulfonate Traditional Name: potassium 2-[[3-[5-(piperidine-1-carbonylthio)tetrazol-1-yl]phenyl]carbamoyl]besylate Formula: C20H19KN6O5S2 MolecularWeight: 526.63036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)SC2=NN=NN2C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)[O-].[K+]

Isomeric SMILES

C1CCN(CC1)C(=O)SC2=NN=NN2C3=CC(=CC=C3)NC(=O)C4=CC=CC=C4S(=O)(=O)[O-].[K+]

InChI

InChI=1S/C20H20N6O5S2.K/c27-18(16-9-2-3-10-17(16)33(29,30)31)21-14-7-6-8-15(13-14)26-19(22-23-24-26)32-20(28)25-11-4-1-5-12-25;/h2-3,6-10,13H,1,4-5,11-12H2,(H,21,27)(H,29,30,31);/q;+1/p-1