1-adamantyl-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone

Systemtic Name: 1-adamantyl-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Openeye Name: 1-adamantyl-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone CAS Name: 1-adamantyl-[2-[(2-chloro-6-fluorophenyl)methylthio]-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: 1-adamantyl-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Traditional Name: 1-adamantyl-[2-[(2-chloro-6-fluoro-benzyl)thio]-2-imidazolin-1-yl]methanone Formula: C21H24ClFN2OS MolecularWeight: 406.944463

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)SCC2=C(C=CC=C2Cl)F)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(C(=N1)SCC2=C(C=CC=C2Cl)F)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H24ClFN2OS/c22-17-2-1-3-18(23)16(17)12-27-20-24-4-5-25(20)19(26)21-9-13-6-14(10-21)8-15(7-13)11-21/h1-3,13-15H,4-12H2