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

Systemtic Name: ethyl 2-[2-[(4-bromanyl-2-ethyl-pyrazol-3-yl)carbonylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetate CAS Name: 2-[2-[[(4-bromo-2-ethyl-3-pyrazolyl)-oxomethyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(4-bromo-2-ethylpyrazole-3-carbonyl)amino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[(4-bromo-2-ethyl-pyrazole-3-carbonyl)amino]thiazol-4-yl]acetic acid ethyl ester Formula: C13H15BrN4O3S MolecularWeight: 387.2522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15BrN4O3S/c1-3-18-11(9(14)6-15-18)12(20)17-13-16-8(7-22-13)5-10(19)21-4-2/h6-7H,3-5H2,1-2H3,(H,16,17,20)