[1-(2-oxidanylidenepyrrolidin-1-yl)-3-piperidin-1-yl-propan-2-yl] carbamimidothioate dihydrochloride

Systemtic Name: [1-(2-oxidanylidenepyrrolidin-1-yl)-3-piperidin-1-yl-propan-2-yl] carbamimidothioate dihydrochloride Openeye Name: 2-[1-[(2-oxopyrrolidin-1-yl)methyl]-2-(1-piperidyl)ethyl]isothiourea dihydrochloride CAS Name: carbamimidothioic acid [1-(2-oxo-1-pyrrolidinyl)-3-(1-piperidinyl)propan-2-yl] ester dihydrochloride IUPAC Name: [1-(2-oxopyrrolidin-1-yl)-3-piperidin-1-ylpropan-2-yl] carbamimidothioate dihydrochloride Traditional Name: 2-[1-[(2-ketopyrrolidino)methyl]-2-piperidino-ethyl]isothiourea dihydrochloride Formula: C13H26Cl2N4OS MolecularWeight: 357.34274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2CCCC2=O)SC(=N)N.Cl.Cl

Isomeric SMILES

C1CCN(CC1)CC(CN2CCCC2=O)SC(=N)N.Cl.Cl

InChI

InChI=1S/C13H24N4OS.2ClH/c14-13(15)19-11(9-16-6-2-1-3-7-16)10-17-8-4-5-12(17)18;;/h11H,1-10H2,(H3,14,15);2*1H