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

Systemtic Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-(4-methoxyphenyl)propanamide IUPAC Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]-N-(4-methoxyphenyl)propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)OC)SC2=NN=C(O2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H27N3O3S/c1-13(19(26)23-17-3-5-18(27-2)6-4-17)29-21-25-24-20(28-21)22-10-14-7-15(11-22)9-16(8-14)12-22/h3-6,13-16H,7-12H2,1-2H3,(H,23,26)/t13-,14?,15?,16?,22?/m1/s1