N-(5-chloranyl-2-fluoranyl-phenyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide

Systemtic Name: N-(5-chloranyl-2-fluoranyl-phenyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Openeye Name: 4-[1-(4-benzyloxybutyl)imidazol-2-yl]-N-(5-chloro-2-fluoro-phenyl)piperidine-1-carbothioamide CAS Name: N-(5-chloro-2-fluorophenyl)-4-[1-(4-phenylmethoxybutyl)-2-imidazolyl]-1-piperidinecarbothioamide IUPAC Name: N-(5-chloro-2-fluorophenyl)-4-[1-(4-phenylmethoxybutyl)imidazol-2-yl]piperidine-1-carbothioamide Traditional Name: 4-[1-(4-benzoxybutyl)imidazol-2-yl]-N-(5-chloro-2-fluoro-phenyl)piperidine-1-carbothioamide Formula: C26H30ClFN4OS MolecularWeight: 501.059003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NC4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1CN(CCC1C2=NC=CN2CCCCOCC3=CC=CC=C3)C(=S)NC4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C26H30ClFN4OS/c27-22-8-9-23(28)24(18-22)30-26(34)32-14-10-21(11-15-32)25-29-12-16-31(25)13-4-5-17-33-19-20-6-2-1-3-7-20/h1-3,6-9,12,16,18,21H,4-5,10-11,13-15,17,19H2,(H,30,34)