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

Systemtic Name: ethyl 2-[2-[(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(4-bromo-2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-bromo-2-ethyl-5-methylpyrazole-3-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C14H17BrN4O3S MolecularWeight: 401.27878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=NC(=CS2)CC(=O)OCC

Isomeric SMILES

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=NC(=CS2)CC(=O)OCC

InChI

InChI=1S/C14H17BrN4O3S/c1-4-19-12(11(15)8(3)18-19)13(21)17-14-16-9(7-23-14)6-10(20)22-5-2/h7H,4-6H2,1-3H3,(H,16,17,21)