N-[4-(phenylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[4-(phenylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[4-(phenylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[4-[[anilino(oxo)methyl]amino]phenyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[4-(phenylcarbamoylamino)phenyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[4-(phenylcarbamoylamino)phenyl]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C20H16F3N5O2S MolecularWeight: 447.43355

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)CSC3=NC=CC(=N3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)NC(=O)CSC3=NC=CC(=N3)C(F)(F)F

InChI

InChI=1S/C20H16F3N5O2S/c21-20(22,23)16-10-11-24-19(28-16)31-12-17(29)25-14-6-8-15(9-7-14)27-18(30)26-13-4-2-1-3-5-13/h1-11H,12H2,(H,25,29)(H2,26,27,30)