(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl N-[3-(trifluoromethyl)phenyl]carbamate

Systemtic Name: (1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl N-[3-(trifluoromethyl)phenyl]carbamate Openeye Name: [1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl N-[3-(trifluoromethyl)phenyl]carbamate CAS Name: N-[3-(trifluoromethyl)phenyl]carbamic acid (1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl ester IUPAC Name: (1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl N-[3-(trifluoromethyl)phenyl]carbamate Traditional Name: N-[3-(trifluoromethyl)phenyl]carbamic acid [1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl ester Formula: C22H16F3N3O2S MolecularWeight: 443.44155

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)COC(=O)NC4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)COC(=O)NC4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C22H16F3N3O2S/c23-22(24,25)16-6-4-7-17(12-16)26-21(29)30-14-15-13-28(18-8-2-1-3-9-18)27-20(15)19-10-5-11-31-19/h1-13H,14H2,(H,26,29)