2-[4-chloranyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidine

Systemtic Name: 2-[4-chloranyl-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidine Openeye Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]-4-(2-thienyl)-6-(trifluoromethyl)pyrimidine CAS Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)-1-pyrazolyl]-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidine IUPAC Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]-4-thiophen-2-yl-6-(trifluoromethyl)pyrimidine Traditional Name: 2-[4-chloro-3,5-bis(3-methoxyphenyl)pyrazol-1-yl]-4-(2-thienyl)-6-(trifluoromethyl)pyrimidine Formula: C26H18ClF3N4O2S MolecularWeight: 542.95993

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=NN2C3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4)C5=CC(=CC=C5)OC)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=NN2C3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4)C5=CC(=CC=C5)OC)Cl

InChI

InChI=1S/C26H18ClF3N4O2S/c1-35-17-8-3-6-15(12-17)23-22(27)24(16-7-4-9-18(13-16)36-2)34(33-23)25-31-19(20-10-5-11-37-20)14-21(32-25)26(28,29)30/h3-14H,1-2H3