4-methyl-1-[2-[methyl(2-oxidanylpropyl)amino]ethylamino]thioxanthen-9-one chloride

Systemtic Name: 4-methyl-1-[2-[methyl(2-oxidanylpropyl)amino]ethylamino]thioxanthen-9-one chloride Openeye Name: 1-[2-[2-hydroxypropyl(methyl)amino]ethylamino]-4-methyl-thioxanthen-9-one chloride CAS Name: 1-[2-[2-hydroxypropyl(methyl)amino]ethylamino]-4-methyl-9-thioxanthenone chloride IUPAC Name: 1-[2-[2-hydroxypropyl(methyl)amino]ethylamino]-4-methylthioxanthen-9-one chloride Traditional Name: 1-[2-[2-hydroxypropyl(methyl)amino]ethylamino]-4-methyl-thioxanthen-9-one chloride Formula: C20H24ClN2O2S- MolecularWeight: 391.93476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NCCN(C)CC(C)O)C(=O)C3=CC=CC=C3S2.[Cl-]

Isomeric SMILES

CC1=C2C(=C(C=C1)NCCN(C)CC(C)O)C(=O)C3=CC=CC=C3S2.[Cl-]

InChI

InChI=1S/C20H24N2O2S.ClH/c1-13-8-9-16(21-10-11-22(3)12-14(2)23)18-19(24)15-6-4-5-7-17(15)25-20(13)18;/h4-9,14,21,23H,10-12H2,1-3H3;1H/p-1