3-[4-[3-(2-chloranyl-9H-thioxanthen-9-yl)propyl]piperazin-1-yl]propan-1-ol hydrochloride

Systemtic Name: 3-[4-[3-(2-chloranyl-9H-thioxanthen-9-yl)propyl]piperazin-1-yl]propan-1-ol hydrochloride Openeye Name: 3-[4-[3-(2-chloro-9H-thioxanthen-9-yl)propyl]piperazin-1-yl]propan-1-ol hydrochloride CAS Name: 3-[4-[3-(2-chloro-9H-thioxanthen-9-yl)propyl]-1-piperazinyl]-1-propanol hydrochloride IUPAC Name: 3-[4-[3-(2-chloro-9H-thioxanthen-9-yl)propyl]piperazin-1-yl]propan-1-ol hydrochloride Traditional Name: 3-[4-[3-(2-chloro-9H-thioxanthen-9-yl)propyl]piperazino]propan-1-ol hydrochloride Formula: C23H30Cl2N2OS MolecularWeight: 453.4681

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCCO.Cl

Isomeric SMILES

C1CN(CCN1CCCC2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCCO.Cl

InChI

InChI=1S/C23H29ClN2OS.ClH/c24-18-8-9-23-21(17-18)19(20-5-1-2-7-22(20)28-23)6-3-10-25-12-14-26(15-13-25)11-4-16-27;/h1-2,5,7-9,17,19,27H,3-4,6,10-16H2;1H