4-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-oxidanyl-pyrimidine-2-carboxamide

Systemtic Name: 4-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-oxidanyl-pyrimidine-2-carboxamide Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-[2-(hydroxycarbamoyl)pyrimidin-4-yl]sulfanylphenyl]urea CAS Name: 4-[[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]-N-hydroxy-2-pyrimidinecarboxamide IUPAC Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-hydroxypyrimidine-2-carboxamide Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]-3-[4-[[2-(hydroxycarbamoyl)pyrimidin-4-yl]thio]phenyl]urea Formula: C19H13ClF3N5O3S MolecularWeight: 483.85143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)SC3=NC(=NC=C3)C(=O)NO

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)SC3=NC(=NC=C3)C(=O)NO

InChI

InChI=1S/C19H13ClF3N5O3S/c20-14-6-3-11(9-13(14)19(21,22)23)26-18(30)25-10-1-4-12(5-2-10)32-15-7-8-24-16(27-15)17(29)28-31/h1-9,31H,(H,28,29)(H2,25,26,30)