2-[[3,5-bis(bromanyl)-2-iodanyl-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[[3,5-bis(bromanyl)-2-iodanyl-phenyl]carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(3,5-dibromo-2-iodo-benzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[[(3,5-dibromo-2-iodophenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(3,5-dibromo-2-iodobenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(3,5-dibromo-2-iodo-benzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C16H13Br2IN2O2S MolecularWeight: 584.06409

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC(=C3I)Br)Br)C(=O)N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC(=C3I)Br)Br)C(=O)N

InChI

InChI=1S/C16H13Br2IN2O2S/c17-7-5-9(13(19)10(18)6-7)15(23)21-16-12(14(20)22)8-3-1-2-4-11(8)24-16/h5-6H,1-4H2,(H2,20,22)(H,21,23)