1-(2-dimethylaminoethylamino)-4-methyl-5-oxidanyl-thioxanthen-9-one hydroiodide

Systemtic Name: 1-(2-dimethylaminoethylamino)-4-methyl-5-oxidanyl-thioxanthen-9-one hydroiodide Openeye Name: 1-(2-dimethylaminoethylamino)-5-hydroxy-4-methyl-thioxanthen-9-one hydroiodide CAS Name: 1-(2-dimethylaminoethylamino)-5-hydroxy-4-methyl-9-thioxanthenone hydroiodide IUPAC Name: 1-(2-dimethylaminoethylamino)-5-hydroxy-4-methylthioxanthen-9-one hydroiodide Traditional Name: 1-(2-dimethylaminoethylamino)-5-hydroxy-4-methyl-thioxanthen-9-one hydroiodide Formula: C18H21IN2O2S MolecularWeight: 456.34101

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NCCN(C)C)C(=O)C3=C(S2)C(=CC=C3)O.I

Isomeric SMILES

CC1=C2C(=C(C=C1)NCCN(C)C)C(=O)C3=C(S2)C(=CC=C3)O.I

InChI

InChI=1S/C18H20N2O2S.HI/c1-11-7-8-13(19-9-10-20(2)3)15-16(22)12-5-4-6-14(21)18(12)23-17(11)15;/h4-8,19,21H,9-10H2,1-3H3;1H