4-methoxy-2-(phenylmethyl)sulfonyl-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine

Systemtic Name: 4-methoxy-2-(phenylmethyl)sulfonyl-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine Openeye Name: 2-benzylsulfonyl-4-methoxy-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine CAS Name: 4-methoxy-2-(phenylmethyl)sulfonyl-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine IUPAC Name: 2-benzylsulfonyl-4-methoxy-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine Traditional Name: 2-benzylsulfonyl-4-methoxy-6-[4-[3-(trifluoromethyl)phenoxy]phenyl]pyrimidine Formula: C25H19F3N2O4S MolecularWeight: 500.48957

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C2=CC=C(C=C2)OC3=CC=CC(=C3)C(F)(F)F)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

COC1=NC(=NC(=C1)C2=CC=C(C=C2)OC3=CC=CC(=C3)C(F)(F)F)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H19F3N2O4S/c1-33-23-15-22(29-24(30-23)35(31,32)16-17-6-3-2-4-7-17)18-10-12-20(13-11-18)34-21-9-5-8-19(14-21)25(26,27)28/h2-15H,16H2,1H3