5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoic acid Openeye Name: 5-methyl-2-[3-(2-thienyl)propanoylamino]benzoic acid CAS Name: 5-methyl-2-[(1-oxo-3-thiophen-2-ylpropyl)amino]benzoic acid IUPAC Name: 5-methyl-2-(3-thiophen-2-ylpropanoylamino)benzoic acid Traditional Name: 5-methyl-2-[3-(2-thienyl)propanoylamino]benzoic acid Formula: C15H15NO3S MolecularWeight: 289.3495

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCC2=CC=CS2)C(=O)O

InChI

InChI=1S/C15H15NO3S/c1-10-4-6-13(12(9-10)15(18)19)16-14(17)7-5-11-3-2-8-20-11/h2-4,6,8-9H,5,7H2,1H3,(H,16,17)(H,18,19)