5-(3-ethoxypropylamino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-(3-ethoxypropylamino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(3-ethoxypropylamino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(3-ethoxypropylamino)-3-(4-morpholin-4-iumylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(3-ethoxypropylamino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(3-ethoxypropylamino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Formula: C12H23N4O2S2+ MolecularWeight: 319.46662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC1=NN(C(=S)S1)C[NH+]2CCOCC2

Isomeric SMILES

CCOCCCNC1=NN(C(=S)S1)C[NH+]2CCOCC2

InChI

InChI=1S/C12H22N4O2S2/c1-2-17-7-3-4-13-11-14-16(12(19)20-11)10-15-5-8-18-9-6-15/h2-10H2,1H3,(H,13,14)/p+1