1-adamantyl-[2-[(3,4-dichlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone

Systemtic Name: 1-adamantyl-[2-[(3,4-dichlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Openeye Name: 1-adamantyl-[2-[(3,4-dichlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone CAS Name: 1-adamantyl-[2-[(3,4-dichlorophenyl)methylthio]-4,5-dihydroimidazol-1-yl]methanone IUPAC Name: 1-adamantyl-[2-[(3,4-dichlorophenyl)methylsulfanyl]-4,5-dihydroimidazol-1-yl]methanone Traditional Name: 1-adamantyl-[2-[(3,4-dichlorobenzyl)thio]-2-imidazolin-1-yl]methanone Formula: C21H24Cl2N2OS MolecularWeight: 423.39906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=N1)SCC2=CC(=C(C=C2)Cl)Cl)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(C(=N1)SCC2=CC(=C(C=C2)Cl)Cl)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H24Cl2N2OS/c22-17-2-1-13(8-18(17)23)12-27-20-24-3-4-25(20)19(26)21-9-14-5-15(10-21)7-16(6-14)11-21/h1-2,8,14-16H,3-7,9-12H2