2-[2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-1,3-thiazol-5-yl]ethanol dihydrochloride

Systemtic Name: 2-[2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-1,3-thiazol-5-yl]ethanol dihydrochloride Openeye Name: 2-[2-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-4-methyl-thiazol-5-yl]ethanol dihydrochloride CAS Name: 2-[2-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-4-methyl-5-thiazolyl]ethanol dihydrochloride IUPAC Name: 2-[2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-1,3-thiazol-5-yl]ethanol dihydrochloride Traditional Name: 2-[2-[1-(4-ethylpiperazino)-3-isoquinolyl]-4-methyl-thiazol-5-yl]ethanol dihydrochloride Formula: C21H28Cl2N4OS MolecularWeight: 455.44422

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC(=C(S4)CCO)C.Cl.Cl

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC(=C(S4)CCO)C.Cl.Cl

InChI

InChI=1S/C21H26N4OS.2ClH/c1-3-24-9-11-25(12-10-24)20-17-7-5-4-6-16(17)14-18(23-20)21-22-15(2)19(27-21)8-13-26;;/h4-7,14,26H,3,8-13H2,1-2H3;2*1H