3-bromanyl-4-butoxy-N-[(3-chlorophenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(3-chlorophenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(3-chlorophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[(3-chloroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(3-chlorophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(3-chlorophenyl)thiocarbamoyl]benzamide Formula: C18H18BrClN2O2S MolecularWeight: 441.76972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrClN2O2S/c1-2-3-9-24-16-8-7-12(10-15(16)19)17(23)22-18(25)21-14-6-4-5-13(20)11-14/h4-8,10-11H,2-3,9H2,1H3,(H2,21,22,23,25)