tert-butyl (2S)-2-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[5-[(2-amino-2-oxoethyl)thio]-1,3,4-oxadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-oxadiazol-2-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C13H20N4O4S MolecularWeight: 328.3873

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(O2)SCC(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@H]1C2=NN=C(O2)SCC(=O)N

InChI

InChI=1S/C13H20N4O4S/c1-13(2,3)21-12(19)17-6-4-5-8(17)10-15-16-11(20-10)22-7-9(14)18/h8H,4-7H2,1-3H3,(H2,14,18)/t8-/m0/s1