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

Systemtic Name: 4-[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-ethoxy-pyridine-2-carboxamide Openeye Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-ethoxy-pyridine-2-carboxamide CAS Name: 4-[[4-[[[4-chloro-3-(trifluoromethyl)anilino]-oxomethyl]amino]phenyl]thio]-N-ethoxy-2-pyridinecarboxamide IUPAC Name: 4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]sulfanyl-N-ethoxypyridine-2-carboxamide Traditional Name: 4-[[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl]thio]-N-ethoxy-picolinamide Formula: C22H18ClF3N4O3S MolecularWeight: 510.91653

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClF3N4O3S/c1-2-33-30-20(31)19-12-16(9-10-27-19)34-15-6-3-13(4-7-15)28-21(32)29-14-5-8-18(23)17(11-14)22(24,25)26/h3-12H,2H2,1H3,(H,30,31)(H2,28,29,32)