N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-2-hexoxy-benzamide

Systemtic Name: N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[(3-chloro-4-fluoro-phenyl)carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[(3-chloro-4-fluorophenyl)carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl]-2-hexoxy-benzamide Formula: C20H22ClFN2O2S MolecularWeight: 408.917283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C20H22ClFN2O2S/c1-2-3-4-7-12-26-18-9-6-5-8-15(18)19(25)24-20(27)23-14-10-11-17(22)16(21)13-14/h5-6,8-11,13H,2-4,7,12H2,1H3,(H2,23,24,25,27)