4-[[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid Openeye Name: 4-[[2-oxo-2-[2-(2-thienyl)ethylamino]ethyl]amino]butanoic acid CAS Name: 4-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid IUPAC Name: 4-[[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]amino]butanoic acid Traditional Name: 4-[[2-keto-2-[2-(2-thienyl)ethylamino]ethyl]amino]butyric acid Formula: C12H18N2O3S MolecularWeight: 270.34792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC(=O)CNCCCC(=O)O

Isomeric SMILES

C1=CSC(=C1)CCNC(=O)CNCCCC(=O)O

InChI

InChI=1S/C12H18N2O3S/c15-11(9-13-6-1-4-12(16)17)14-7-5-10-3-2-8-18-10/h2-3,8,13H,1,4-7,9H2,(H,14,15)(H,16,17)