1-(1-adamantyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(1-adamantyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(1-adamantyl)-2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone CAS Name: 1-(1-adamantyl)-2-[[5-(phenylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(1-adamantyl)-2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(1-adamantyl)-2-[(5-benzyl-1,3,4-oxadiazol-2-yl)thio]ethanone Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NN=C(O4)CC5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)CSC4=NN=C(O4)CC5=CC=CC=C5

InChI

InChI=1S/C21H24N2O2S/c24-18(21-10-15-6-16(11-21)8-17(7-15)12-21)13-26-20-23-22-19(25-20)9-14-4-2-1-3-5-14/h1-5,15-17H,6-13H2