5-butyl-2-thiophen-2-yl-1,3-oxazole-4-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N=C(O1)C2=CC=CS2)C(=O)O

Isomeric SMILES

CCCCC1=C(N=C(O1)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C12H13NO3S/c1-2-3-5-8-10(12(14)15)13-11(16-8)9-6-4-7-17-9/h4,6-7H,2-3,5H2,1H3,(H,14,15)