5-bromanyl-2-butoxy-N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-butoxy-N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-butoxy-N-[(2-isobutoxyphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-butoxy-N-[[2-(2-methylpropoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-butoxy-N-[[2-(2-methylpropoxy)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-butoxy-N-[(2-isobutoxyphenyl)thiocarbamoyl]benzamide Formula: C22H27BrN2O3S MolecularWeight: 479.43038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC=C2OCC(C)C

InChI

InChI=1S/C22H27BrN2O3S/c1-4-5-12-27-19-11-10-16(23)13-17(19)21(26)25-22(29)24-18-8-6-7-9-20(18)28-14-15(2)3/h6-11,13,15H,4-5,12,14H2,1-3H3,(H2,24,25,26,29)