N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]-3-oxidanyl-2H-pyridine-3-carboxamide

Systemtic Name: N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]-3-oxidanyl-2H-pyridine-3-carboxamide Openeye Name: N-[(3-fluoro-4-pentoxy-phenyl)carbamothioyl]-3-hydroxy-2H-pyridine-3-carboxamide CAS Name: N-[(3-fluoro-4-pentoxyanilino)-sulfanylidenemethyl]-3-hydroxy-2H-pyridine-3-carboxamide IUPAC Name: N-[(3-fluoro-4-pentoxyphenyl)carbamothioyl]-3-hydroxy-2H-pyridine-3-carboxamide Traditional Name: N-[(4-amoxy-3-fluoro-phenyl)thiocarbamoyl]-3-hydroxy-2H-pyridine-3-carboxamide Formula: C18H22FN3O3S MolecularWeight: 379.448983

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22FN3O3S/c1-2-3-4-10-25-15-7-6-13(11-14(15)19)21-17(26)22-16(23)18(24)8-5-9-20-12-18/h5-9,11,24H,2-4,10,12H2,1H3,(H2,21,22,23,26)