5-chloranyl-N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Openeye Name: 5-chloro-N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[[3-[dimethylamino(oxo)methyl]phenyl]methyl]-1-(4-fluorophenyl)-3-methyl-4-pyrazolecarboxamide IUPAC Name: 5-chloro-N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(4-fluorophenyl)-3-methylpyrazole-4-carboxamide Traditional Name: 5-chloro-N-[3-(dimethylcarbamoyl)benzyl]-1-(4-fluorophenyl)-3-methyl-pyrazole-4-carboxamide Formula: C21H20ClFN4O2 MolecularWeight: 414.860503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C)Cl)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCC2=CC=CC(=C2)C(=O)N(C)C)Cl)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H20ClFN4O2/c1-13-18(19(22)27(25-13)17-9-7-16(23)8-10-17)20(28)24-12-14-5-4-6-15(11-14)21(29)26(2)3/h4-11H,12H2,1-3H3,(H,24,28)