2-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(2-furyl)thiazol-4-yl]methylamino]-3-methyl-butanoic acid CAS Name: 2-[[2-(2-furanyl)-4-thiazolyl]methylamino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(furan-2-yl)-1,3-thiazol-4-yl]methylamino]-3-methylbutanoic acid Traditional Name: 2-[[2-(2-furyl)thiazol-4-yl]methylamino]-3-methyl-butyric acid Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC1=CSC(=N1)C2=CC=CO2

Isomeric SMILES

CC(C)C(C(=O)O)NCC1=CSC(=N1)C2=CC=CO2

InChI

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