3-phenyl-3-(2-thiophen-2-ylsulfanylethanoylamino)propanoic acid

Systemtic Name: 3-phenyl-3-(2-thiophen-2-ylsulfanylethanoylamino)propanoic acid Openeye Name: 3-phenyl-3-[[2-(2-thienylsulfanyl)acetyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-(thiophen-2-ylthio)ethyl]amino]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[(2-thiophen-2-ylsulfanylacetyl)amino]propanoic acid Traditional Name: 3-phenyl-3-[[2-(2-thienylthio)acetyl]amino]propionic acid Formula: C15H15NO3S2 MolecularWeight: 321.4145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)CSC2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)NC(=O)CSC2=CC=CS2

InChI

InChI=1S/C15H15NO3S2/c17-13(10-21-15-7-4-8-20-15)16-12(9-14(18)19)11-5-2-1-3-6-11/h1-8,12H,9-10H2,(H,16,17)(H,18,19)