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

Systemtic Name: ethyl 2-[2-[3-(4-bromanyl-3-nitro-pyrazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-(4-bromo-3-nitro-pyrazol-1-yl)propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-(4-bromo-3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(4-bromo-3-nitropyrazol-1-yl)propanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-(4-bromo-3-nitro-pyrazol-1-yl)propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C13H14BrN5O5S MolecularWeight: 432.24976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCN2C=C(C(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C13H14BrN5O5S/c1-2-24-11(21)5-8-7-25-13(15-8)16-10(20)3-4-18-6-9(14)12(17-18)19(22)23/h6-7H,2-5H2,1H3,(H,15,16,20)