1-[1-(diethylamino)propan-2-ylamino]-4-methyl-thioxanthen-9-one hydrochloride

Systemtic Name: 1-[1-(diethylamino)propan-2-ylamino]-4-methyl-thioxanthen-9-one hydrochloride Openeye Name: 1-[[2-(diethylamino)-1-methyl-ethyl]amino]-4-methyl-thioxanthen-9-one hydrochloride CAS Name: 1-[1-(diethylamino)propan-2-ylamino]-4-methyl-9-thioxanthenone hydrochloride IUPAC Name: 1-[1-(diethylamino)propan-2-ylamino]-4-methylthioxanthen-9-one hydrochloride Traditional Name: 1-[[2-(diethylamino)-1-methyl-ethyl]amino]-4-methyl-thioxanthen-9-one hydrochloride Formula: C21H27ClN2OS MolecularWeight: 390.96988

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(C)NC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.Cl

Isomeric SMILES

CCN(CC)CC(C)NC1=C2C(=C(C=C1)C)SC3=CC=CC=C3C2=O.Cl

InChI

InChI=1S/C21H26N2OS.ClH/c1-5-23(6-2)13-15(4)22-17-12-11-14(3)21-19(17)20(24)16-9-7-8-10-18(16)25-21;/h7-12,15,22H,5-6,13H2,1-4H3;1H