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

Systemtic Name: 4-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyrimidine-2-carboxamide Openeye Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyrimidine-2-carboxamide CAS Name: 4-[[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]-N-methyl-2-pyrimidinecarboxamide IUPAC Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methylpyrimidine-2-carboxamide Traditional Name: 4-[[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]thio]-N-methyl-pyrimidine-2-carboxamide Formula: C20H15ClF3N5O2S MolecularWeight: 481.87861

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CNC(=O)C1=NC=CC(=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)17-26-9-8-16(29-17)32-13-5-2-11(3-6-13)27-19(31)28-12-4-7-15(21)14(10-12)20(22,23)24/h2-10H,1H3,(H,25,30)(H2,27,28,31)