4-chloranyl-N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide

Systemtic Name: 4-chloranyl-N-[(3-fluoranyl-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide Openeye Name: 4-chloro-N-[(3-fluoro-4-pentoxy-phenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide CAS Name: 4-chloro-N-[(3-fluoro-4-pentoxyanilino)-sulfanylidenemethyl]-2-furo[3,2-c]pyridinecarboxamide IUPAC Name: 4-chloro-N-[(3-fluoro-4-pentoxyphenyl)carbamothioyl]furo[3,2-c]pyridine-2-carboxamide Traditional Name: N-[(4-amoxy-3-fluoro-phenyl)thiocarbamoyl]-4-chloro-furo[3,2-c]pyridine-2-carboxamide Formula: C20H19ClFN3O3S MolecularWeight: 435.899563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=C(O2)C=CN=C3Cl)F

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=C(O2)C=CN=C3Cl)F

InChI

InChI=1S/C20H19ClFN3O3S/c1-2-3-4-9-27-16-6-5-12(10-14(16)22)24-20(29)25-19(26)17-11-13-15(28-17)7-8-23-18(13)21/h5-8,10-11H,2-4,9H2,1H3,(H2,24,25,26,29)