1-(3,4-dihydro-2H-thiochromen-4-yl)-2-(2-pyridin-2-ylethyl)piperazine trihydrochloride

Systemtic Name: 1-(3,4-dihydro-2H-thiochromen-4-yl)-2-(2-pyridin-2-ylethyl)piperazine trihydrochloride Openeye Name: 2-[2-(2-pyridyl)ethyl]-1-thiochroman-4-yl-piperazine trihydrochloride CAS Name: 1-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-2-[2-(2-pyridinyl)ethyl]piperazine trihydrochloride IUPAC Name: 1-(3,4-dihydro-2H-thiochromen-4-yl)-2-(2-pyridin-2-ylethyl)piperazine trihydrochloride Traditional Name: 2-[2-(2-pyridyl)ethyl]-1-thiochroman-4-yl-piperazine trihydrochloride Formula: C20H28Cl3N3S MolecularWeight: 448.88042

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C1N3CCNCC3CCC4=CC=CC=N4.Cl.Cl.Cl

Isomeric SMILES

C1CSC2=CC=CC=C2C1N3CCNCC3CCC4=CC=CC=N4.Cl.Cl.Cl

InChI

InChI=1S/C20H25N3S.3ClH/c1-2-7-20-18(6-1)19(10-14-24-20)23-13-12-21-15-17(23)9-8-16-5-3-4-11-22-16;;;/h1-7,11,17,19,21H,8-10,12-15H2;3*1H