6-chloranyl-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one hydrochloride

Systemtic Name: 6-chloranyl-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one hydrochloride Openeye Name: 6-chloro-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one hydrochloride CAS Name: 6-chloro-1-(2-diethylaminoethylamino)-4-methyl-9-thioxanthenone hydrochloride IUPAC Name: 6-chloro-1-(2-diethylaminoethylamino)-4-methylthioxanthen-9-one hydrochloride Traditional Name: 6-chloro-1-(2-diethylaminoethylamino)-4-methyl-thioxanthen-9-one hydrochloride Formula: C20H24Cl2N2OS MolecularWeight: 411.38836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=CC(=C3)Cl.Cl

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=CC(=C3)Cl.Cl

InChI

InChI=1S/C20H23ClN2OS.ClH/c1-4-23(5-2)11-10-22-16-9-6-13(3)20-18(16)19(24)15-8-7-14(21)12-17(15)25-20;/h6-9,12,22H,4-5,10-11H2,1-3H3;1H