methyl 5-[[4-[(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(4-bromanyl-2-ethyl-5-methyl-pyrazol-3-yl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[(4-bromo-2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(4-bromo-2-ethyl-5-methylpyrazole-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(4-bromo-2-ethyl-5-methyl-pyrazole-3-carbonyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C17H18BrN5O4 MolecularWeight: 436.25992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=CN(N=C2)CC3=CC=C(O3)C(=O)OC

Isomeric SMILES

CCN1C(=C(C(=N1)C)Br)C(=O)NC2=CN(N=C2)CC3=CC=C(O3)C(=O)OC

InChI

InChI=1S/C17H18BrN5O4/c1-4-23-15(14(18)10(2)21-23)16(24)20-11-7-19-22(8-11)9-12-5-6-13(27-12)17(25)26-3/h5-8H,4,9H2,1-3H3,(H,20,24)