1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride

Systemtic Name: 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride Openeye Name: 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride CAS Name: 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride IUPAC Name: 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride Traditional Name: 1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine hydrate dihydrochloride Formula: C20H27Cl2NOS MolecularWeight: 400.40548

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24.O.Cl.Cl

Isomeric SMILES

CN1CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24.O.Cl.Cl

InChI

InChI=1S/C20H23NS.2ClH.H2O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;2*1H;1H2