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

Systemtic Name: 3-[4-bromanyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[(3,4-diethoxyphenyl)methyl]propanamide Openeye Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[(3,4-diethoxyphenyl)methyl]propanamide CAS Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]-N-[(3,4-diethoxyphenyl)methyl]propanamide IUPAC Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-[(3,4-diethoxyphenyl)methyl]propanamide Traditional Name: 3-[4-bromo-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(3,4-diethoxybenzyl)propionamide Formula: C19H23BrF3N3O3 MolecularWeight: 478.30343

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Br)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)CCN2C(=C(C(=N2)C(F)(F)F)Br)C)OCC

InChI

InChI=1S/C19H23BrF3N3O3/c1-4-28-14-7-6-13(10-15(14)29-5-2)11-24-16(27)8-9-26-12(3)17(20)18(25-26)19(21,22)23/h6-7,10H,4-5,8-9,11H2,1-3H3,(H,24,27)