4-[3-fluoranyl-4-[2-(4-fluorophenyl)ethanoylcarbamothioylamino]phenoxy]pyridine-2-carboxamide

Systemtic Name: 4-[3-fluoranyl-4-[2-(4-fluorophenyl)ethanoylcarbamothioylamino]phenoxy]pyridine-2-carboxamide Openeye Name: 4-[3-fluoro-4-[[2-(4-fluorophenyl)acetyl]carbamothioylamino]phenoxy]pyridine-2-carboxamide CAS Name: 4-[3-fluoro-4-[[[[2-(4-fluorophenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenoxy]-2-pyridinecarboxamide IUPAC Name: 4-[3-fluoro-4-[[2-(4-fluorophenyl)acetyl]carbamothioylamino]phenoxy]pyridine-2-carboxamide Traditional Name: 4-[3-fluoro-4-[[2-(4-fluorophenyl)acetyl]thiocarbamoylamino]phenoxy]picolinamide Formula: C21H16F2N4O3S MolecularWeight: 442.438546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)NC(=S)NC2=C(C=C(C=C2)OC3=CC(=NC=C3)C(=O)N)F)F

Isomeric SMILES

C1=CC(=CC=C1CC(=O)NC(=S)NC2=C(C=C(C=C2)OC3=CC(=NC=C3)C(=O)N)F)F

InChI

InChI=1S/C21H16F2N4O3S/c22-13-3-1-12(2-4-13)9-19(28)27-21(31)26-17-6-5-14(10-16(17)23)30-15-7-8-25-18(11-15)20(24)29/h1-8,10-11H,9H2,(H2,24,29)(H2,26,27,28,31)