3-bromanyl-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[(3-chloranyl-4-fluoranyl-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[(3-chloro-4-fluoroanilino)-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[(3-chloro-4-fluorophenyl)carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[(3-chloro-4-fluoro-phenyl)thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C17H15BrClFN2O3S MolecularWeight: 461.733003

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=C(C=C2)F)Cl)Br

InChI

InChI=1S/C17H15BrClFN2O3S/c1-24-6-7-25-15-5-2-10(8-12(15)18)16(23)22-17(26)21-11-3-4-14(20)13(19)9-11/h2-5,8-9H,6-7H2,1H3,(H2,21,22,23,26)