5-(2-methylpropyl)-2-thiophen-2-yl-1,3-oxazole-4-carboxylic acid

Systemtic Name: 5-(2-methylpropyl)-2-thiophen-2-yl-1,3-oxazole-4-carboxylic acid Openeye Name: 5-isobutyl-2-(2-thienyl)oxazole-4-carboxylic acid CAS Name: 5-(2-methylpropyl)-2-thiophen-2-yl-4-oxazolecarboxylic acid IUPAC Name: 5-(2-methylpropyl)-2-thiophen-2-yl-1,3-oxazole-4-carboxylic acid Traditional Name: 5-isobutyl-2-(2-thienyl)oxazole-4-carboxylic acid Formula: C12H13NO3S MolecularWeight: 251.30152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(O1)C2=CC=CS2)C(=O)O

Isomeric SMILES

CC(C)CC1=C(N=C(O1)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C12H13NO3S/c1-7(2)6-8-10(12(14)15)13-11(16-8)9-4-3-5-17-9/h3-5,7H,6H2,1-2H3,(H,14,15)