(2S)-3-(1H-imidazol-5-yl)-2-(3-imidazol-1-ylpropanoylamino)propanoate

Systemtic Name: (2S)-3-(1H-imidazol-5-yl)-2-(3-imidazol-1-ylpropanoylamino)propanoate Openeye Name: (2S)-3-(1H-imidazol-5-yl)-2-(3-imidazol-1-ylpropanoylamino)propanoate CAS Name: (2S)-3-(1H-imidazol-5-yl)-2-[[3-(1-imidazolyl)-1-oxopropyl]amino]propanoate IUPAC Name: (2S)-3-(1H-imidazol-5-yl)-2-(3-imidazol-1-ylpropanoylamino)propanoate Traditional Name: (2S)-3-(1H-imidazol-5-yl)-2-(3-imidazol-1-ylpropanoylamino)propionate Formula: C12H14N5O3- MolecularWeight: 276.27126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCC(=O)NC(CC2=CN=CN2)C(=O)[O-]

Isomeric SMILES

C1=CN(C=N1)CCC(=O)N[C@@H](CC2=CN=CN2)C(=O)[O-]

InChI

InChI=1S/C12H15N5O3/c18-11(1-3-17-4-2-13-8-17)16-10(12(19)20)5-9-6-14-7-15-9/h2,4,6-8,10H,1,3,5H2,(H,14,15)(H,16,18)(H,19,20)/p-1/t10-/m0/s1