N1,N4-bis(3-morpholin-4-ium-4-ylpropyl)piperazine-1,4-dicarbothioamide

Systemtic Name: N1,N4-bis(3-morpholin-4-ium-4-ylpropyl)piperazine-1,4-dicarbothioamide Openeye Name: N1,N4-bis(3-morpholin-4-ium-4-ylpropyl)piperazine-1,4-dicarbothioamide CAS Name: N1,N4-bis[3-(4-morpholin-4-iumyl)propyl]piperazine-1,4-dicarbothioamide IUPAC Name: 1-N,4-N-bis(3-morpholin-4-ium-4-ylpropyl)piperazine-1,4-dicarbothioamide Traditional Name: N,N'-bis(3-morpholin-4-ium-4-ylpropyl)piperazine-1,4-dicarbothioamide Formula: C20H40N6O2S2+2 MolecularWeight: 460.7006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCCNC(=S)N2CCN(CC2)C(=S)NCCC[NH+]3CCOCC3

Isomeric SMILES

C1COCC[NH+]1CCCNC(=S)N2CCN(CC2)C(=S)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C20H38N6O2S2/c29-19(21-3-1-5-23-11-15-27-16-12-23)25-7-9-26(10-8-25)20(30)22-4-2-6-24-13-17-28-18-14-24/h1-18H2,(H,21,29)(H,22,30)/p+2