N-[4-(2-azanylpyridin-4-yl)oxy-3-fluoranyl-phenyl]-N-carbamothioyl-ethanamide

Systemtic Name: N-[4-(2-azanylpyridin-4-yl)oxy-3-fluoranyl-phenyl]-N-carbamothioyl-ethanamide Openeye Name: N-[4-[(2-amino-4-pyridyl)oxy]-3-fluoro-phenyl]-N-carbamothioyl-acetamide CAS Name: N-[4-[(2-amino-4-pyridinyl)oxy]-3-fluorophenyl]-N-carbamothioylacetamide IUPAC Name: N-[4-(2-aminopyridin-4-yl)oxy-3-fluorophenyl]-N-carbamothioylacetamide Traditional Name: N-[4-[(2-amino-4-pyridyl)oxy]-3-fluoro-phenyl]-N-thiocarbamoyl-acetamide Formula: C14H13FN4O2S MolecularWeight: 320.342023

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC(=C(C=C1)OC2=CC(=NC=C2)N)F)C(=S)N

Isomeric SMILES

CC(=O)N(C1=CC(=C(C=C1)OC2=CC(=NC=C2)N)F)C(=S)N

InChI

InChI=1S/C14H13FN4O2S/c1-8(20)19(14(17)22)9-2-3-12(11(15)6-9)21-10-4-5-18-13(16)7-10/h2-7H,1H3,(H2,16,18)(H2,17,22)