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

Systemtic Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-bis(1,3-thiazol-2-yl)methanol Openeye Name: [4-[1-(4-ethylpiperazin-1-yl)-3-isoquinolyl]phenyl]-di(thiazol-2-yl)methanol CAS Name: [4-[1-(4-ethyl-1-piperazinyl)-3-isoquinolinyl]phenyl]-bis(2-thiazolyl)methanol IUPAC Name: [4-[1-(4-ethylpiperazin-1-yl)isoquinolin-3-yl]phenyl]-bis(1,3-thiazol-2-yl)methanol Traditional Name: [4-[1-(4-ethylpiperazino)-3-isoquinolyl]phenyl]-di(thiazol-2-yl)methanol Formula: C28H27N5OS2 MolecularWeight: 513.67688

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5=NC=CS5)(C6=NC=CS6)O

Isomeric SMILES

CCN1CCN(CC1)C2=NC(=CC3=CC=CC=C32)C4=CC=C(C=C4)C(C5=NC=CS5)(C6=NC=CS6)O

InChI

InChI=1S/C28H27N5OS2/c1-2-32-13-15-33(16-14-32)25-23-6-4-3-5-21(23)19-24(31-25)20-7-9-22(10-8-20)28(34,26-29-11-17-35-26)27-30-12-18-36-27/h3-12,17-19,34H,2,13-16H2,1H3