3-bromanyl-4-butoxy-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-butoxy-N-[(3-chloranyl-4-methyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-butoxy-N-[(3-chloro-4-methyl-phenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-butoxy-N-[(3-chloro-4-methylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-butoxy-N-[(3-chloro-4-methylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-butoxy-N-[(3-chloro-4-methyl-phenyl)thiocarbamoyl]benzamide Formula: C19H20BrClN2O2S MolecularWeight: 455.7963

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrClN2O2S/c1-3-4-9-25-17-8-6-13(10-15(17)20)18(24)23-19(26)22-14-7-5-12(2)16(21)11-14/h5-8,10-11H,3-4,9H2,1-2H3,(H2,22,23,24,26)