3-bromanyl-4-butoxy-N-[(2-chlorophenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(2-chlorophenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(2-chlorophenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[(2-chloroanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(2-chlorophenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(2-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=C2Cl)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2Cl)Br

InChI

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