6-[2-fluoranyl-4-[2-(4-fluoranylphenoxy)ethanoylcarbamothioylamino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide

Systemtic Name: 6-[2-fluoranyl-4-[2-(4-fluoranylphenoxy)ethanoylcarbamothioylamino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide Openeye Name: 6-[2-fluoro-4-[[2-(4-fluorophenoxy)acetyl]carbamothioylamino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide CAS Name: 6-[2-fluoro-4-[[[[2-(4-fluorophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide IUPAC Name: 6-[2-fluoro-4-[[2-(4-fluorophenoxy)acetyl]carbamothioylamino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide Traditional Name: 6-[2-fluoro-4-[[2-(4-fluorophenoxy)acetyl]thiocarbamoylamino]phenoxy]-1,2-dihydropyrimidine-2-carboxamide Formula: C20H17F2N5O4S MolecularWeight: 461.441886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCC(=O)NC(=S)NC2=CC(=C(C=C2)OC3=CC=NC(N3)C(=O)N)F)F

Isomeric SMILES

C1=CC(=CC=C1OCC(=O)NC(=S)NC2=CC(=C(C=C2)OC3=CC=NC(N3)C(=O)N)F)F

InChI

InChI=1S/C20H17F2N5O4S/c21-11-1-4-13(5-2-11)30-10-16(28)26-20(32)25-12-3-6-15(14(22)9-12)31-17-7-8-24-19(27-17)18(23)29/h1-9,19,27H,10H2,(H2,23,29)(H2,25,26,28,32)