N-(2-phenylsulfanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(2-phenylsulfanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide Openeye Name: N-(2-phenylsulfanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-[2-(phenylthio)phenyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]propanamide IUPAC Name: N-(2-phenylsulfanylphenyl)-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylpropanamide Traditional Name: N-[2-(phenylthio)phenyl]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]propionamide Formula: C20H16F3N3OS2 MolecularWeight: 435.48575

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)SC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1SC2=CC=CC=C2)SC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C20H16F3N3OS2/c1-13(28-19-24-12-11-17(26-19)20(21,22)23)18(27)25-15-9-5-6-10-16(15)29-14-7-3-2-4-8-14/h2-13H,1H3,(H,25,27)