4-(4-piperazin-1-ylbut-2-ynyl)thiomorpholine dihydrochloride

Systemtic Name: 4-(4-piperazin-1-ylbut-2-ynyl)thiomorpholine dihydrochloride Openeye Name: 4-(4-piperazin-1-ylbut-2-ynyl)thiomorpholine dihydrochloride CAS Name: 4-[4-(1-piperazinyl)but-2-ynyl]thiomorpholine dihydrochloride IUPAC Name: 4-(4-piperazin-1-ylbut-2-ynyl)thiomorpholine dihydrochloride Traditional Name: 4-(4-piperazinobut-2-ynyl)thiomorpholine dihydrochloride Formula: C12H23Cl2N3S MolecularWeight: 312.30212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC#CCN2CCSCC2.Cl.Cl

Isomeric SMILES

C1CN(CCN1)CC#CCN2CCSCC2.Cl.Cl

InChI

InChI=1S/C12H21N3S.2ClH/c1(5-14-7-3-13-4-8-14)2-6-15-9-11-16-12-10-15;;/h13H,3-12H2;2*1H