1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride

Systemtic Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride Openeye Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride CAS Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-9-thioxanthenone hydrochloride IUPAC Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methylthioxanthen-9-one hydrochloride Traditional Name: 1-[2-(2-hydroxyethylamino)ethylamino]-4-methyl-thioxanthen-9-one hydrochloride Formula: C18H21ClN2O2S MolecularWeight: 364.88954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)NCCNCCO)C(=O)C3=CC=CC=C3S2.Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)NCCNCCO)C(=O)C3=CC=CC=C3S2.Cl

InChI

InChI=1S/C18H20N2O2S.ClH/c1-12-6-7-14(20-9-8-19-10-11-21)16-17(22)13-4-2-3-5-15(13)23-18(12)16;/h2-7,19-21H,8-11H2,1H3;1H