1-[2-[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[2-(3-methylbutanoylamino)thiazol-4-yl]acetyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[2-[(3-methyl-1-oxobutyl)amino]-4-thiazolyl]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[2-(3-methylbutanoylamino)-1,3-thiazol-4-yl]acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[2-(isovalerylamino)thiazol-4-yl]acetyl]proline Formula: C15H21N3O4S MolecularWeight: 339.40994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NC(=CS1)CC(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(C)CC(=O)NC1=NC(=CS1)CC(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C15H21N3O4S/c1-9(2)6-12(19)17-15-16-10(8-23-15)7-13(20)18-5-3-4-11(18)14(21)22/h8-9,11H,3-7H2,1-2H3,(H,21,22)(H,16,17,19)