3-[[2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]propanoic acid

Systemtic Name: 3-[[2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]propanoic acid Openeye Name: 3-[[2-[allyl(2-thienylmethyl)amino]-2-oxo-ethyl]amino]propanoic acid CAS Name: 3-[[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]propanoic acid IUPAC Name: 3-[[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]amino]propanoic acid Traditional Name: 3-[[2-[allyl(2-thenyl)amino]-2-keto-ethyl]amino]propionic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CS1)C(=O)CNCCC(=O)O

Isomeric SMILES

C=CCN(CC1=CC=CS1)C(=O)CNCCC(=O)O

InChI

InChI=1S/C13H18N2O3S/c1-2-7-15(10-11-4-3-8-19-11)12(16)9-14-6-5-13(17)18/h2-4,8,14H,1,5-7,9-10H2,(H,17,18)