5-bromanyl-N-[(5-tert-butyl-3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]-2-chloranyl-benzamide

Systemtic Name: 5-bromanyl-N-[(5-tert-butyl-3-chloranyl-2-oxidanyl-phenyl)carbamothioyl]-2-chloranyl-benzamide Openeye Name: 5-bromo-N-[(5-tert-butyl-3-chloro-2-hydroxy-phenyl)carbamothioyl]-2-chloro-benzamide CAS Name: 5-bromo-N-[(5-tert-butyl-3-chloro-2-hydroxyanilino)-sulfanylidenemethyl]-2-chlorobenzamide IUPAC Name: 5-bromo-N-[(5-tert-butyl-3-chloro-2-hydroxyphenyl)carbamothioyl]-2-chlorobenzamide Traditional Name: 5-bromo-N-[(5-tert-butyl-3-chloro-2-hydroxy-phenyl)thiocarbamoyl]-2-chloro-benzamide Formula: C18H17BrCl2N2O2S MolecularWeight: 476.21478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrCl2N2O2S/c1-18(2,3)9-6-13(21)15(24)14(7-9)22-17(26)23-16(25)11-8-10(19)4-5-12(11)20/h4-8,24H,1-3H3,(H2,22,23,25,26)