N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[3,5-bis(chloranyl)-4-oxidanyl-phenyl]carbamothioyl]-3-chloranyl-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[(3,5-dichloro-4-hydroxy-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[(3,5-dichloro-4-hydroxyanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[(3,5-dichloro-4-hydroxyphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[(3,5-dichloro-4-hydroxy-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C16H9Cl3N2O2S2 MolecularWeight: 431.74386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NC3=CC(=C(C(=C3)Cl)O)Cl)Cl

InChI

InChI=1S/C16H9Cl3N2O2S2/c17-9-5-7(6-10(18)13(9)22)20-16(24)21-15(23)14-12(19)8-3-1-2-4-11(8)25-14/h1-6,22H,(H2,20,21,23,24)