5-bromanyl-2-butoxy-N-[(3,5-dimethylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-[(3,5-dimethylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[(3,5-dimethylphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[(3,5-dimethylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[(3,5-dimethylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[(3,5-dimethylphenyl)thiocarbamoyl]benzamide Formula: C20H23BrN2O2S MolecularWeight: 435.37782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C20H23BrN2O2S/c1-4-5-8-25-18-7-6-15(21)12-17(18)19(24)23-20(26)22-16-10-13(2)9-14(3)11-16/h6-7,9-12H,4-5,8H2,1-3H3,(H2,22,23,24,26)