N-(4-chloranyl-2-fluoranyl-phenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: N-(4-chloro-2-fluorophenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionamide Formula: C21H21ClFN3O2 MolecularWeight: 401.861743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)NC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

CC1=C(C(=NN1C2=CC(=CC=C2)OC)C)CCC(=O)NC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C21H21ClFN3O2/c1-13-18(8-10-21(27)24-20-9-7-15(22)11-19(20)23)14(2)26(25-13)16-5-4-6-17(12-16)28-3/h4-7,9,11-12H,8,10H2,1-3H3,(H,24,27)