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

Systemtic Name: 2-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-4-carboxamide Openeye Name: 2-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methyl-pyridine-4-carboxamide CAS Name: 2-[[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]-N-methyl-4-pyridinecarboxamide IUPAC Name: 2-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-methylpyridine-4-carboxamide Traditional Name: 2-[[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]thio]-N-methyl-isonicotinamide Formula: C21H16ClF3N4O2S MolecularWeight: 480.89055

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16ClF3N4O2S/c1-26-19(30)12-8-9-27-18(10-12)32-15-5-2-13(3-6-15)28-20(31)29-14-4-7-17(22)16(11-14)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)