4-methyl-6-(2-methylbutyl)-2-methylsulfonyl-5-[2,4,6-tris(fluoranyl)phenyl]pyrimidine

Systemtic Name: 4-methyl-6-(2-methylbutyl)-2-methylsulfonyl-5-[2,4,6-tris(fluoranyl)phenyl]pyrimidine Openeye Name: 4-methyl-6-(2-methylbutyl)-2-methylsulfonyl-5-(2,4,6-trifluorophenyl)pyrimidine CAS Name: 4-methyl-6-(2-methylbutyl)-2-methylsulfonyl-5-(2,4,6-trifluorophenyl)pyrimidine IUPAC Name: 4-methyl-6-(2-methylbutyl)-2-methylsulfonyl-5-(2,4,6-trifluorophenyl)pyrimidine Traditional Name: 2-mesyl-4-methyl-6-(2-methylbutyl)-5-(2,4,6-trifluorophenyl)pyrimidine Formula: C17H19F3N2O2S MolecularWeight: 372.40517

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=NC(=NC(=C1C2=C(C=C(C=C2F)F)F)C)S(=O)(=O)C

Isomeric SMILES

CCC(C)CC1=NC(=NC(=C1C2=C(C=C(C=C2F)F)F)C)S(=O)(=O)C

InChI

InChI=1S/C17H19F3N2O2S/c1-5-9(2)6-14-15(10(3)21-17(22-14)25(4,23)24)16-12(19)7-11(18)8-13(16)20/h7-9H,5-6H2,1-4H3