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

Systemtic Name: 3-[2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[allyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]thio]propanoic acid IUPAC Name: 3-[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-[allyl(2-thenyl)amino]-2-keto-ethyl]thio]propionic acid Formula: C13H17NO3S2 MolecularWeight: 299.40898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO3S2/c1-2-6-14(9-11-4-3-7-19-11)12(15)10-18-8-5-13(16)17/h2-4,7H,1,5-6,8-10H2,(H,16,17)