methyl (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoate

Systemtic Name: methyl (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoate Openeye Name: methyl (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoate CAS Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanoate Traditional Name: (2R)-2-[[5-(1-adamantyl)-1,3,4-oxadiazol-2-yl]thio]propionic acid methyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NN=C(O1)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C[C@H](C(=O)OC)SC1=NN=C(O1)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C16H22N2O3S/c1-9(13(19)20-2)22-15-18-17-14(21-15)16-6-10-3-11(7-16)5-12(4-10)8-16/h9-12H,3-8H2,1-2H3/t9-,10?,11?,12?,16?/m1/s1