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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1CC(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

C1=CSC=C1CC(=O)N[C@@H](CC2=CN=CN2)C(=O)O

InChI

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