3-(piperidin-1-ium-1-ylmethyl)-5-(propan-2-ylamino)-1,3,4-thiadiazole-2-thione

Systemtic Name: 3-(piperidin-1-ium-1-ylmethyl)-5-(propan-2-ylamino)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(isopropylamino)-3-(piperidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-thione CAS Name: 3-(1-piperidin-1-iumylmethyl)-5-(propan-2-ylamino)-1,3,4-thiadiazole-2-thione IUPAC Name: 3-(piperidin-1-ium-1-ylmethyl)-5-(propan-2-ylamino)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(isopropylamino)-3-(piperidin-1-ium-1-ylmethyl)-1,3,4-thiadiazole-2-thione Formula: C11H21N4S2+ MolecularWeight: 273.44124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NN(C(=S)S1)C[NH+]2CCCCC2

Isomeric SMILES

CC(C)NC1=NN(C(=S)S1)C[NH+]2CCCCC2

InChI

InChI=1S/C11H20N4S2/c1-9(2)12-10-13-15(11(16)17-10)8-14-6-4-3-5-7-14/h9H,3-8H2,1-2H3,(H,12,13)/p+1