N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]but-2-ynamide

Systemtic Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]but-2-ynamide Openeye Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]but-2-ynamide CAS Name: N-[4-[3,5-bis(trifluoromethyl)-1-pyrazolyl]phenyl]-2-butynamide IUPAC Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]but-2-ynamide Traditional Name: N-[4-[3,5-bis(trifluoromethyl)pyrazol-1-yl]phenyl]but-2-ynamide Formula: C15H9F6N3O MolecularWeight: 361.241879

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)NC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC#CC(=O)NC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C15H9F6N3O/c1-2-3-13(25)22-9-4-6-10(7-5-9)24-12(15(19,20)21)8-11(23-24)14(16,17)18/h4-8H,1H3,(H,22,25)