[2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(1,3-thiazol-2-yl)phenyl]methanol

Systemtic Name: [2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(1,3-thiazol-2-yl)phenyl]methanol Openeye Name: [2-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]-5-thiazol-2-yl-phenyl]methanol CAS Name: [2-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]-5-(2-thiazolyl)phenyl]methanol IUPAC Name: [2-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]-5-(1,3-thiazol-2-yl)phenyl]methanol Traditional Name: [2-[1-(4-ethylpiperazino)-3-isoquinolyl]-5-thiazol-2-yl-phenyl]methanol Formula: C25H26N4OS MolecularWeight: 430.56514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N4OS/c1-2-28-10-12-29(13-11-28)24-22-6-4-3-5-18(22)16-23(27-24)21-8-7-19(15-20(21)17-30)25-26-9-14-31-25/h3-9,14-16,30H,2,10-13,17H2,1H3