2-(3-bromophenyl)-3-phenyl-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-(3-bromophenyl)-3-phenyl-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 2-(3-bromophenyl)-3-phenyl-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2-(3-bromophenyl)-3-phenyl-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2-(3-bromophenyl)-3-phenyl-5-thiophen-2-yl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 2-(3-bromophenyl)-3-phenyl-5-(2-thienyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C23H13BrF3N3S MolecularWeight: 500.33363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2C4=CC(=CC=C4)Br)C(F)(F)F)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)C2=C3N=C(C=C(N3N=C2C4=CC(=CC=C4)Br)C(F)(F)F)C5=CC=CS5

InChI

InChI=1S/C23H13BrF3N3S/c24-16-9-4-8-15(12-16)21-20(14-6-2-1-3-7-14)22-28-17(18-10-5-11-31-18)13-19(23(25,26)27)30(22)29-21/h1-13H