4-(4-bromanylthiophen-2-yl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine

Systemtic Name: 4-(4-bromanylthiophen-2-yl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine Openeye Name: 4-(4-bromo-2-thienyl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine CAS Name: 4-(4-bromo-2-thiophenyl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine IUPAC Name: 4-(4-bromothiophen-2-yl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine Traditional Name: 4-(4-bromo-2-thienyl)-6-(3-methoxyphenyl)-2-[4-(trifluoromethyl)phenyl]pyrimidine Formula: C22H14BrF3N2OS MolecularWeight: 491.32357

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=CC(=NC(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC(=CS4)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2=CC(=NC(=N2)C3=CC=C(C=C3)C(F)(F)F)C4=CC(=CS4)Br

InChI

InChI=1S/C22H14BrF3N2OS/c1-29-17-4-2-3-14(9-17)18-11-19(20-10-16(23)12-30-20)28-21(27-18)13-5-7-15(8-6-13)22(24,25)26/h2-12H,1H3