ethyl 2-[4-[(5-bromanylfuran-2-yl)carbonylamino]-3,5-dimethyl-pyrazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[(5-bromanylfuran-2-yl)carbonylamino]-3,5-dimethyl-pyrazol-1-yl]ethanoate Openeye Name: ethyl 2-[4-[(5-bromofuran-2-carbonyl)amino]-3,5-dimethyl-pyrazol-1-yl]acetate CAS Name: 2-[4-[[(5-bromo-2-furanyl)-oxomethyl]amino]-3,5-dimethyl-1-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[(5-bromofuran-2-carbonyl)amino]-3,5-dimethylpyrazol-1-yl]acetate Traditional Name: 2-[4-[(5-bromo-2-furoyl)amino]-3,5-dimethyl-pyrazol-1-yl]acetic acid ethyl ester Formula: C14H16BrN3O4 MolecularWeight: 370.19854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC=C(O2)Br)C

Isomeric SMILES

CCOC(=O)CN1C(=C(C(=N1)C)NC(=O)C2=CC=C(O2)Br)C

InChI

InChI=1S/C14H16BrN3O4/c1-4-21-12(19)7-18-9(3)13(8(2)17-18)16-14(20)10-5-6-11(15)22-10/h5-6H,4,7H2,1-3H3,(H,16,20)