N-[[4-(6-azanylpyrimidin-4-yl)oxy-3-fluoranyl-phenyl]carbamothioyl]-2-(4-fluorophenyl)ethanamide

Systemtic Name: N-[[4-(6-azanylpyrimidin-4-yl)oxy-3-fluoranyl-phenyl]carbamothioyl]-2-(4-fluorophenyl)ethanamide Openeye Name: N-[[4-(6-aminopyrimidin-4-yl)oxy-3-fluoro-phenyl]carbamothioyl]-2-(4-fluorophenyl)acetamide CAS Name: N-[[4-[(6-amino-4-pyrimidinyl)oxy]-3-fluoroanilino]-sulfanylidenemethyl]-2-(4-fluorophenyl)acetamide IUPAC Name: N-[[4-(6-aminopyrimidin-4-yl)oxy-3-fluorophenyl]carbamothioyl]-2-(4-fluorophenyl)acetamide Traditional Name: N-[[4-(6-aminopyrimidin-4-yl)oxy-3-fluoro-phenyl]thiocarbamoyl]-2-(4-fluorophenyl)acetamide Formula: C19H15F2N5O2S MolecularWeight: 415.416506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15F2N5O2S/c20-12-3-1-11(2-4-12)7-17(27)26-19(29)25-13-5-6-15(14(21)8-13)28-18-9-16(22)23-10-24-18/h1-6,8-10H,7H2,(H2,22,23,24)(H2,25,26,27,29)