3-bromanyl-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-4-phenethyloxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-4-phenethyloxy-benzamide Openeye Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)carbamothioyl]-4-phenethyloxy-benzamide CAS Name: 3-bromo-N-[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-4-phenethyloxybenzamide IUPAC Name: 3-bromo-N-[(3-chloro-4-fluorophenyl)carbamothioyl]-4-phenethyloxybenzamide Traditional Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl]-4-phenethyloxy-benzamide Formula: C22H17BrClFN2O2S MolecularWeight: 507.802983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3)F)Cl)Br

Isomeric SMILES

C1=CC=C(C=C1)CCOC2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3)F)Cl)Br

InChI

InChI=1S/C22H17BrClFN2O2S/c23-17-12-15(6-9-20(17)29-11-10-14-4-2-1-3-5-14)21(28)27-22(30)26-16-7-8-19(25)18(24)13-16/h1-9,12-13H,10-11H2,(H2,26,27,28,30)