2-[4-[3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]piperazin-1-yl]-N-quinolin-6-yl-ethanamide

Systemtic Name: 2-[4-[3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]piperazin-1-yl]-N-quinolin-6-yl-ethanamide Openeye Name: 2-[4-[2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazin-1-yl]-N-(6-quinolyl)acetamide CAS Name: 2-[4-[2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-1-piperazinyl]-N-(6-quinolinyl)acetamide IUPAC Name: 2-[4-[2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazin-1-yl]-N-quinolin-6-ylacetamide Traditional Name: 2-[4-[2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazino]-N-(6-quinolyl)acetamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCC(CN3CCN(CC3)CC(=O)NC4=CC5=C(C=C4)N=CC=C5)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OCC(CN3CCN(CC3)CC(=O)NC4=CC5=C(C=C4)N=CC=C5)O

InChI

InChI=1S/C26H29N5O3S/c1-18-28-24-14-22(5-7-25(24)35-18)34-17-21(32)15-30-9-11-31(12-10-30)16-26(33)29-20-4-6-23-19(13-20)3-2-8-27-23/h2-8,13-14,21,32H,9-12,15-17H2,1H3,(H,29,33)