5-chloranyl-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]pyrazole-4-carboxamide

Systemtic Name: 5-chloranyl-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]pyrazole-4-carboxamide Openeye Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]pyrazole-4-carboxamide CAS Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]-4-pyrazolecarboxamide IUPAC Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]pyrazole-4-carboxamide Traditional Name: 5-chloro-1-(4-fluorophenyl)-3-methyl-N-[3-(3-methylphenoxy)propyl]pyrazole-4-carboxamide Formula: C21H21ClFN3O2 MolecularWeight: 401.861743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCCCNC(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O2/c1-14-5-3-6-18(13-14)28-12-4-11-24-21(27)19-15(2)25-26(20(19)22)17-9-7-16(23)8-10-17/h3,5-10,13H,4,11-12H2,1-2H3,(H,24,27)