1-(1-adamantyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(1-adamantyl)-2-[1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(1-adamantyl)-2-(1-benzylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(1-adamantyl)-2-[[1-(phenylmethyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-(1-benzylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(1-adamantyl)-2-[(1-benzylimidazol-2-yl)thio]ethanone Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=CN4CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NC=CN4CC5=CC=CC=C5

InChI

InChI=1S/C22H26N2OS/c25-20(22-11-17-8-18(12-22)10-19(9-17)13-22)15-26-21-23-6-7-24(21)14-16-4-2-1-3-5-16/h1-7,17-19H,8-15H2