2-(azepan-1-yl)-1-[2-(5-bromanylthiophen-2-yl)quinolin-4-yl]ethanol

Systemtic Name: 2-(azepan-1-yl)-1-[2-(5-bromanylthiophen-2-yl)quinolin-4-yl]ethanol Openeye Name: 2-(azepan-1-yl)-1-[2-(5-bromo-2-thienyl)-4-quinolyl]ethanol CAS Name: 2-(1-azepanyl)-1-[2-(5-bromo-2-thiophenyl)-4-quinolinyl]ethanol IUPAC Name: 2-(azepan-1-yl)-1-[2-(5-bromothiophen-2-yl)quinolin-4-yl]ethanol Traditional Name: 2-(azepan-1-yl)-1-[2-(5-bromo-2-thienyl)-4-quinolyl]ethanol Formula: C21H23BrN2OS MolecularWeight: 431.38912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC(C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Br)O

Isomeric SMILES

C1CCCN(CC1)CC(C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Br)O

InChI

InChI=1S/C21H23BrN2OS/c22-21-10-9-20(26-21)18-13-16(15-7-3-4-8-17(15)23-18)19(25)14-24-11-5-1-2-6-12-24/h3-4,7-10,13,19,25H,1-2,5-6,11-12,14H2