(2S)-3-(1H-imidazol-5-yl)-2-(2-thiophen-2-ylethanoylamino)propanoic acid

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(2-thiophen-2-ylethanoylamino)propanoic acid Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-[[2-(2-thienyl)acetyl]amino]propanoic acid CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[(1-oxo-2-thiophen-2-ylethyl)amino]propanoic acid IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-[(2-thiophen-2-ylacetyl)amino]propanoic acid Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-[[2-(2-thienyl)acetyl]amino]propionic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CC(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C12H13N3O3S/c16-11(5-9-2-1-3-19-9)15-10(12(17)18)4-8-6-13-7-14-8/h1-3,6-7,10H,4-5H2,(H,13,14)(H,15,16)(H,17,18)/t10-/m0/s1