6-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyrimidine-4-carboxamide

Systemtic Name: 6-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyrimidine-4-carboxamide Openeye Name: 6-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyrimidine-4-carboxamide CAS Name: 6-[[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]-N-methyl-4-pyrimidinecarboxamide IUPAC Name: 6-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methylpyrimidine-4-carboxamide Traditional Name: 6-[[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]thio]-N-methyl-pyrimidine-4-carboxamide Formula: C20H15ClF3N5O2S MolecularWeight: 481.87861

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=NC=N1)SC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CNC(=O)C1=CC(=NC=N1)SC2=CC=C(C=C2)NC(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C20H15ClF3N5O2S/c1-25-18(30)16-9-17(27-10-26-16)32-13-5-2-11(3-6-13)28-19(31)29-12-4-7-15(21)14(8-12)20(22,23)24/h2-10H,1H3,(H,25,30)(H2,28,29,31)