3-bromanyl-4-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[(3-hexoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(3-hexoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[(3-hexoxyphenyl)thiocarbamoyl]benzamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

Isomeric SMILES

CCCCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCC)Br

InChI

InChI=1S/C22H27BrN2O3S/c1-3-5-6-7-13-28-18-10-8-9-17(15-18)24-22(29)25-21(26)16-11-12-20(27-4-2)19(23)14-16/h8-12,14-15H,3-7,13H2,1-2H3,(H2,24,25,26,29)