N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C22H19F3N4OS2 MolecularWeight: 476.53767

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C(C)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C(C)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3)C

InChI

InChI=1S/C22H19F3N4OS2/c1-4-15-12(2)31-20(16(15)11-26)29-19(30)13(3)32-21-27-17(14-8-6-5-7-9-14)10-18(28-21)22(23,24)25/h5-10,13H,4H2,1-3H3,(H,29,30)