N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]-1,2-oxazole-5-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]-1,2-oxazole-5-carboxamide Openeye Name: N-[(3-fluoro-4-pentoxy-phenyl)carbamothioyl]isoxazole-5-carboxamide CAS Name: N-[(3-fluoro-4-pentoxyanilino)-sulfanylidenemethyl]-5-isoxazolecarboxamide IUPAC Name: N-[(3-fluoro-4-pentoxyphenyl)carbamothioyl]-1,2-oxazole-5-carboxamide Traditional Name: N-[(4-amoxy-3-fluoro-phenyl)thiocarbamoyl]isoxazole-5-carboxamide Formula: C16H18FN3O3S MolecularWeight: 351.395823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=NO2)F

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=NO2)F

InChI

InChI=1S/C16H18FN3O3S/c1-2-3-4-9-22-13-6-5-11(10-12(13)17)19-16(24)20-15(21)14-7-8-18-23-14/h5-8,10H,2-4,9H2,1H3,(H2,19,20,21,24)