2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-5-(2-phenylmethoxyethyl)-1,3-thiazole

Systemtic Name: 2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-5-(2-phenylmethoxyethyl)-1,3-thiazole Openeye Name: 5-(2-benzyloxyethyl)-2-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-4-methyl-thiazole CAS Name: 2-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-4-methyl-5-(2-phenylmethoxyethyl)thiazole IUPAC Name: 2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-4-methyl-5-(2-phenylmethoxyethyl)-1,3-thiazole Traditional Name: 5-(2-benzoxyethyl)-2-[1-(4-ethylpiperazino)-3-isoquinolyl]-4-methyl-thiazole Formula: C28H32N4OS MolecularWeight: 472.64488

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC(=C(S4)CCOCC5=CC=CC=C5)C

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=NC(=C(S4)CCOCC5=CC=CC=C5)C

InChI

InChI=1S/C28H32N4OS/c1-3-31-14-16-32(17-15-31)27-24-12-8-7-11-23(24)19-25(30-27)28-29-21(2)26(34-28)13-18-33-20-22-9-5-4-6-10-22/h4-12,19H,3,13-18,20H2,1-2H3