ethyl 2-[2-[(2-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(2-ethyl-4-nitro-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(2-ethyl-4-nitro-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(2-ethyl-4-nitro-3-pyrazolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(2-ethyl-4-nitropyrazole-3-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(2-ethyl-4-nitro-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C13H15N5O5S MolecularWeight: 353.3537

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)CC(=O)OCC

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)CC(=O)OCC

InChI

InChI=1S/C13H15N5O5S/c1-3-17-11(9(6-14-17)18(21)22)12(20)16-13-15-8(7-24-13)5-10(19)23-4-2/h6-7H,3-5H2,1-2H3,(H,15,16,20)