[4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-(1,3-thiazol-2-yl)methanone

Systemtic Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-(1,3-thiazol-2-yl)methanone Openeye Name: [4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]-thiazol-2-yl-methanone CAS Name: [4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-(2-thiazolyl)methanone IUPAC Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-(1,3-thiazol-2-yl)methanone Traditional Name: [4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]-thiazol-2-yl-methanone Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)C5=NC=CS5

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(=O)C5=NC=CS5

InChI

InChI=1S/C25H24N4OS/c1-2-28-12-14-29(15-13-28)24-21-6-4-3-5-20(21)17-22(27-24)18-7-9-19(10-8-18)23(30)25-26-11-16-31-25/h3-11,16-17H,2,12-15H2,1H3