6-oxidanylidene-6-(2-thiophen-2-ylethylcarbamoylamino)hexanoic acid

Systemtic Name: 6-oxidanylidene-6-(2-thiophen-2-ylethylcarbamoylamino)hexanoic acid Openeye Name: 6-oxo-6-[2-(2-thienyl)ethylcarbamoylamino]hexanoic acid CAS Name: 6-oxo-6-[[oxo-(2-thiophen-2-ylethylamino)methyl]amino]hexanoic acid IUPAC Name: 6-oxo-6-(2-thiophen-2-ylethylcarbamoylamino)hexanoic acid Traditional Name: 6-keto-6-[2-(2-thienyl)ethylcarbamoylamino]hexanoic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)NC(=O)CCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)NC(=O)CCCCC(=O)O

InChI

InChI=1S/C13H18N2O4S/c16-11(5-1-2-6-12(17)18)15-13(19)14-8-7-10-4-3-9-20-10/h3-4,9H,1-2,5-8H2,(H,17,18)(H2,14,15,16,19)