2-[2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(4-nitropyrazol-1-yl)ethanoylamino]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiazol-4-yl]acetic acid CAS Name: 2-[2-[[2-(4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[[2-(4-nitropyrazol-1-yl)acetyl]amino]thiazol-4-yl]acetic acid Formula: C10H9N5O5S MolecularWeight: 311.27396

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CC(=O)NC2=NC(=CS2)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=NN1CC(=O)NC2=NC(=CS2)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H9N5O5S/c16-8(4-14-3-7(2-11-14)15(19)20)13-10-12-6(5-21-10)1-9(17)18/h2-3,5H,1,4H2,(H,17,18)(H,12,13,16)