5-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-N-[4-(4-fluoranylphenoxy)butyl]-3-methyl-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-5-chloro-N-[4-(4-fluorophenoxy)butyl]-3-methyl-pyrazole-4-carboxamide CAS Name: 5-chloro-N-[4-(4-fluorophenoxy)butyl]-3-methyl-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-5-chloro-N-[4-(4-fluorophenoxy)butyl]-3-methylpyrazole-4-carboxamide Traditional Name: 1-benzyl-5-chloro-N-[4-(4-fluorophenoxy)butyl]-3-methyl-pyrazole-4-carboxamide Formula: C22H23ClFN3O2 MolecularWeight: 415.888323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCCCOC2=CC=C(C=C2)F)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCCCOC2=CC=C(C=C2)F)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H23ClFN3O2/c1-16-20(21(23)27(26-16)15-17-7-3-2-4-8-17)22(28)25-13-5-6-14-29-19-11-9-18(24)10-12-19/h2-4,7-12H,5-6,13-15H2,1H3,(H,25,28)