1-[4-(1,3-benzothiazol-2-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol Openeye Name: 1-[4-(1,3-benzothiazol-2-ylmethylamino)-1-piperidyl]-1-(6-methoxy-4-quinolyl)ethanol CAS Name: 1-[4-(1,3-benzothiazol-2-ylmethylamino)-1-piperidinyl]-1-(6-methoxy-4-quinolinyl)ethanol IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylmethylamino)piperidin-1-yl]-1-(6-methoxyquinolin-4-yl)ethanol Traditional Name: 1-[4-(1,3-benzothiazol-2-ylmethylamino)piperidino]-1-(6-methoxy-4-quinolyl)ethanol Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C2C=C(C=CC2=NC=C1)OC)(N3CCC(CC3)NCC4=NC5=CC=CC=C5S4)O

Isomeric SMILES

CC(C1=C2C=C(C=CC2=NC=C1)OC)(N3CCC(CC3)NCC4=NC5=CC=CC=C5S4)O

InChI

InChI=1S/C25H28N4O2S/c1-25(30,20-9-12-26-21-8-7-18(31-2)15-19(20)21)29-13-10-17(11-14-29)27-16-24-28-22-5-3-4-6-23(22)32-24/h3-9,12,15,17,27,30H,10-11,13-14,16H2,1-2H3