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

Systemtic Name: (2S)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methylphenyl)propanamide Openeye Name: (2S)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(m-tolyl)propanamide CAS Name: (2S)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-(m-tolyl)propionamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O2S/c1-13-4-3-5-18(6-13)23-19(26)14(2)28-21-25-24-20(27-21)22-10-15-7-16(11-22)9-17(8-15)12-22/h3-6,14-17H,7-12H2,1-2H3,(H,23,26)/t14-,15?,16?,17?,22?/m0/s1