4-bromanyl-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]-4-pyrazolyl]-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-[1-[(3,4-diethoxyphenyl)methyl]pyrazol-4-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-N-[1-(3,4-diethoxybenzyl)pyrazol-4-yl]-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C20H21BrF3N5O3 MolecularWeight: 516.31165

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=NN(C(=C3Br)C(F)(F)F)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN2C=C(C=N2)NC(=O)C3=NN(C(=C3Br)C(F)(F)F)C)OCC

InChI

InChI=1S/C20H21BrF3N5O3/c1-4-31-14-7-6-12(8-15(14)32-5-2)10-29-11-13(9-25-29)26-19(30)17-16(21)18(20(22,23)24)28(3)27-17/h6-9,11H,4-5,10H2,1-3H3,(H,26,30)