4-butyl-2-propan-2-yl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 4-butyl-2-propan-2-yl-1,3-thiazole-5-carboxylic acid Openeye Name: 4-butyl-2-isopropyl-thiazole-5-carboxylic acid CAS Name: 4-butyl-2-propan-2-yl-5-thiazolecarboxylic acid IUPAC Name: 4-butyl-2-propan-2-yl-1,3-thiazole-5-carboxylic acid Traditional Name: 4-butyl-2-isopropyl-thiazole-5-carboxylic acid Formula: C11H17NO2S MolecularWeight: 227.32318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(SC(=N1)C(C)C)C(=O)O

Isomeric SMILES

CCCCC1=C(SC(=N1)C(C)C)C(=O)O

InChI

InChI=1S/C11H17NO2S/c1-4-5-6-8-9(11(13)14)15-10(12-8)7(2)3/h7H,4-6H2,1-3H3,(H,13,14)