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

Systemtic Name: 2-azanyl-3-[2-oxidanylidene-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]sulfanyl-propanoic acid Openeye Name: 3-[2-[allyl(2-thienylmethyl)amino]-2-oxo-ethyl]sulfanyl-2-amino-propanoic acid CAS Name: 2-amino-3-[[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]thio]propanoic acid IUPAC Name: 2-amino-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]-2-amino-propionic acid Formula: C13H18N2O3S2 MolecularWeight: 314.42362

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=CS1)C(=O)CSCC(C(=O)O)N

Isomeric SMILES

C=CCN(CC1=CC=CS1)C(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C13H18N2O3S2/c1-2-5-15(7-10-4-3-6-20-10)12(16)9-19-8-11(14)13(17)18/h2-4,6,11H,1,5,7-9,14H2,(H,17,18)