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

Systemtic Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(phenylmethyl)propanamide Openeye Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-benzyl-propanamide CAS Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-(phenylmethyl)propanamide IUPAC Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-benzylpropanamide Traditional Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-benzyl-propionamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-14(19(26)23-13-15-5-3-2-4-6-15)28-21-25-24-20(27-21)22-10-16-7-17(11-22)9-18(8-16)12-22/h2-6,14,16-18H,7-13H2,1H3,(H,23,26)/t14-,16?,17?,18?,22?/m1/s1