ethyl 2-[2-[(4-bromanyl-3-nitro-1H-pyrazol-5-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[(4-bromanyl-3-nitro-1H-pyrazol-5-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(4-bromo-3-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-bromo-3-nitro-1H-pyrazole-5-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C11H10BrN5O5S MolecularWeight: 404.1966

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)C2=C(C(=NN2)[N+](=O)[O-])Br

InChI

InChI=1S/C11H10BrN5O5S/c1-2-22-6(18)3-5-4-23-11(13-5)14-10(19)8-7(12)9(16-15-8)17(20)21/h4H,2-3H2,1H3,(H,15,16)(H,13,14,19)