3,3-dimethyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]butanoic acid

Systemtic Name: 3,3-dimethyl-2-[2-(thiophen-2-ylcarbonylamino)propanoylamino]butanoic acid Openeye Name: 3,3-dimethyl-2-[2-(thiophene-2-carbonylamino)propanoylamino]butanoic acid CAS Name: 3,3-dimethyl-2-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]propyl]amino]butanoic acid IUPAC Name: 3,3-dimethyl-2-[2-(thiophene-2-carbonylamino)propanoylamino]butanoic acid Traditional Name: 3,3-dimethyl-2-[2-(2-thenoylamino)propanoylamino]butyric acid Formula: C14H20N2O4S MolecularWeight: 312.3846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C(=O)O)C(C)(C)C)NC(=O)C1=CC=CS1

Isomeric SMILES

CC(C(=O)NC(C(=O)O)C(C)(C)C)NC(=O)C1=CC=CS1

InChI

InChI=1S/C14H20N2O4S/c1-8(15-12(18)9-6-5-7-21-9)11(17)16-10(13(19)20)14(2,3)4/h5-8,10H,1-4H3,(H,15,18)(H,16,17)(H,19,20)