4-[bis(fluoranyl)methyl]-N-butyl-6-(4-methylsulfonylphenyl)pyrimidin-2-amine

Systemtic Name: 4-[bis(fluoranyl)methyl]-N-butyl-6-(4-methylsulfonylphenyl)pyrimidin-2-amine Openeye Name: N-butyl-4-(difluoromethyl)-6-(4-methylsulfonylphenyl)pyrimidin-2-amine CAS Name: N-butyl-4-(difluoromethyl)-6-(4-methylsulfonylphenyl)-2-pyrimidinamine IUPAC Name: N-butyl-4-(difluoromethyl)-6-(4-methylsulfonylphenyl)pyrimidin-2-amine Traditional Name: butyl-[4-(difluoromethyl)-6-(4-mesylphenyl)pyrimidin-2-yl]amine Formula: C16H19F2N3O2S MolecularWeight: 355.402766

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=CC(=N1)C(F)F)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCCNC1=NC(=CC(=N1)C(F)F)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C16H19F2N3O2S/c1-3-4-9-19-16-20-13(10-14(21-16)15(17)18)11-5-7-12(8-6-11)24(2,22)23/h5-8,10,15H,3-4,9H2,1-2H3,(H,19,20,21)