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

Systemtic Name: 5-bromanyl-2-butoxy-N-[(2,5-dimethylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[(2,5-dimethylphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[(2,5-dimethylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[(2,5-dimethylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[(2,5-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=C(C=CC(=C2)C)C

Isomeric SMILES

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

InChI

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