2-[[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[5-(5-bromanylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methyl-butanoic acid Openeye Name: 2-[[5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methyl-butanoic acid CAS Name: 2-[[5-(5-bromo-2-thiophenyl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methylbutanoic acid IUPAC Name: 2-[[5-(5-bromothiophen-2-yl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methylbutanoic acid Traditional Name: 2-[[5-(5-bromo-2-thienyl)-1,3,4-oxadiazol-2-yl]methylamino]-3-methyl-butyric acid Formula: C12H14BrN3O3S MolecularWeight: 360.22686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=NN=C(O1)C2=CC=C(S2)Br

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=NN=C(O1)C2=CC=C(S2)Br

InChI

InChI=1S/C12H14BrN3O3S/c1-6(2)10(12(17)18)14-5-9-15-16-11(19-9)7-3-4-8(13)20-7/h3-4,6,10,14H,5H2,1-2H3,(H,17,18)