1-[3-(dimethylamino)propylamino]-2-methoxy-4-methyl-thioxanthen-9-one hydroiodide

Systemtic Name: 1-[3-(dimethylamino)propylamino]-2-methoxy-4-methyl-thioxanthen-9-one hydroiodide Openeye Name: 1-[3-(dimethylamino)propylamino]-2-methoxy-4-methyl-thioxanthen-9-one hydroiodide CAS Name: 1-[3-(dimethylamino)propylamino]-2-methoxy-4-methyl-9-thioxanthenone hydroiodide IUPAC Name: 1-[3-(dimethylamino)propylamino]-2-methoxy-4-methylthioxanthen-9-one hydroiodide Traditional Name: 1-[3-(dimethylamino)propylamino]-2-methoxy-4-methyl-thioxanthen-9-one hydroiodide Formula: C20H25IN2O2S MolecularWeight: 484.39417

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1SC3=CC=CC=C3C2=O)NCCCN(C)C)OC.I

Isomeric SMILES

CC1=CC(=C(C2=C1SC3=CC=CC=C3C2=O)NCCCN(C)C)OC.I

InChI

InChI=1S/C20H24N2O2S.HI/c1-13-12-15(24-4)18(21-10-7-11-22(2)3)17-19(23)14-8-5-6-9-16(14)25-20(13)17;/h5-6,8-9,12,21H,7,10-11H2,1-4H3;1H