3,6-bis(chloranyl)-N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(2-chloranyl-4-iodanyl-phenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(2-chloro-4-iodo-phenyl)carbamothioyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(2-chloro-4-iodoanilino)-sulfanylidenemethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(2-chloro-4-iodophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(2-chloro-4-iodo-phenyl)thiocarbamoyl]benzothiophene-2-carboxamide Formula: C16H8Cl3IN2OS2 MolecularWeight: 541.64099

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)NC(=S)NC3=C(C=C(C=C3)I)Cl

Isomeric SMILES

C1=CC2=C(C=C1Cl)SC(=C2Cl)C(=O)NC(=S)NC3=C(C=C(C=C3)I)Cl

InChI

InChI=1S/C16H8Cl3IN2OS2/c17-7-1-3-9-12(5-7)25-14(13(9)19)15(23)22-16(24)21-11-4-2-8(20)6-10(11)18/h1-6H,(H2,21,22,23,24)