5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-1-(4-fluorophenyl)-N-homoveratryl-3-methyl-pyrazole-4-carboxamide Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCC2=CC(=C(C=C2)OC)OC)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21ClFN3O3/c1-13-19(20(22)26(25-13)16-7-5-15(23)6-8-16)21(27)24-11-10-14-4-9-17(28-2)18(12-14)29-3/h4-9,12H,10-11H2,1-3H3,(H,24,27)