3-bromanyl-4-hexoxy-N-[[2-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-[[2-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-bromo-4-hexoxy-N-[[2-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-4-hexoxy-N-[[2-[(2-methoxyethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-hexoxy-N-[[2-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-bromo-4-hexoxy-N-[[2-(2-methoxyethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C24H30BrN3O4S MolecularWeight: 536.4817

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCOC)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCOC)Br

InChI

InChI=1S/C24H30BrN3O4S/c1-3-4-5-8-14-32-21-12-11-17(16-19(21)25)22(29)28-24(33)27-20-10-7-6-9-18(20)23(30)26-13-15-31-2/h6-7,9-12,16H,3-5,8,13-15H2,1-2H3,(H,26,30)(H2,27,28,29,33)