1-[3-(dimethylamino)propylamino]-4-oxidanyl-thioxanthen-9-one hydroiodide

Systemtic Name: 1-[3-(dimethylamino)propylamino]-4-oxidanyl-thioxanthen-9-one hydroiodide Openeye Name: 1-[3-(dimethylamino)propylamino]-4-hydroxy-thioxanthen-9-one hydroiodide CAS Name: 1-[3-(dimethylamino)propylamino]-4-hydroxy-9-thioxanthenone hydroiodide IUPAC Name: 1-[3-(dimethylamino)propylamino]-4-hydroxythioxanthen-9-one hydroiodide Traditional Name: 1-[3-(dimethylamino)propylamino]-4-hydroxy-thioxanthen-9-one hydroiodide Formula: C18H21IN2O2S MolecularWeight: 456.34101

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCNC1=C2C(=C(C=C1)O)SC3=CC=CC=C3C2=O.I

Isomeric SMILES

CN(C)CCCNC1=C2C(=C(C=C1)O)SC3=CC=CC=C3C2=O.I

InChI

InChI=1S/C18H20N2O2S.HI/c1-20(2)11-5-10-19-13-8-9-14(21)18-16(13)17(22)12-6-3-4-7-15(12)23-18;/h3-4,6-9,19,21H,5,10-11H2,1-2H3;1H