3-methyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylamino]butanoic acid

Systemtic Name: 3-methyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylamino]butanoic acid Openeye Name: 3-methyl-2-[[2-(2-thienyl)oxazol-4-yl]methylamino]butanoic acid CAS Name: 3-methyl-2-[(2-thiophen-2-yl-4-oxazolyl)methylamino]butanoic acid IUPAC Name: 3-methyl-2-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methylamino]butanoic acid Traditional Name: 3-methyl-2-[[2-(2-thienyl)oxazol-4-yl]methylamino]butyric acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=COC(=N1)C2=CC=CS2

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=COC(=N1)C2=CC=CS2

InChI

InChI=1S/C13H16N2O3S/c1-8(2)11(13(16)17)14-6-9-7-18-12(15-9)10-4-3-5-19-10/h3-5,7-8,11,14H,6H2,1-2H3,(H,16,17)