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1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride

1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride

Systemtic Name:1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride
Openeye Name:1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride
CAS Name:1-(methylaminomethyl)-9-thioxanthenone hydrate dihydrochloride
IUPAC Name:1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride
Traditional Name:1-(methylaminomethyl)thioxanthen-9-one hydrate dihydrochloride
Formula: C15H17Cl2NO2S
MolecularWeight: 346.27198
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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=C2C(=CC=C1)SC3=CC=CC=C3C2=O.O.Cl.Cl


Isomeric SMILES

CNCC1=C2C(=CC=C1)SC3=CC=CC=C3C2=O.O.Cl.Cl


InChI

InChI=1S/C15H13NOS.2ClH.H2O/c1-16-9-10-5-4-8-13-14(10)15(17)11-6-2-3-7-12(11)18-13;;;/h2-8,16H,9H2,1H3;2*1H;1H2


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