N-[(4-fluorophenyl)methyl]-3-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-3-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide Openeye Name: N-[(4-fluorophenyl)methyl]-3-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propanamide CAS Name: N-[(4-fluorophenyl)methyl]-3-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfonyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methyl]-3-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonylpropanamide Traditional Name: N-(4-fluorobenzyl)-3-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfonyl-propionamide Formula: C21H17F4N3O3S MolecularWeight: 467.436593

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC(=N2)S(=O)(=O)CCC(=O)NCC3=CC=C(C=C3)F)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC(=N2)S(=O)(=O)CCC(=O)NCC3=CC=C(C=C3)F)C(F)(F)F

InChI

InChI=1S/C21H17F4N3O3S/c22-16-8-6-14(7-9-16)13-26-19(29)10-11-32(30,31)20-27-17(15-4-2-1-3-5-15)12-18(28-20)21(23,24)25/h1-9,12H,10-11,13H2,(H,26,29)