N-[3-[(3-iodanylphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-[(3-iodanylphenyl)carbonylcarbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Openeye Name: N-[3-[(3-iodobenzoyl)carbamothioylamino]phenyl]benzofuran-2-carboxamide CAS Name: N-[3-[[[[(3-iodophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-benzofurancarboxamide IUPAC Name: N-[3-[(3-iodobenzoyl)carbamothioylamino]phenyl]-1-benzofuran-2-carboxamide Traditional Name: N-[3-[(3-iodobenzoyl)thiocarbamoylamino]phenyl]coumarilamide Formula: C23H16IN3O3S MolecularWeight: 541.36091

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC(=CC=C4)I

Isomeric SMILES

C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC(=CC=C3)NC(=S)NC(=O)C4=CC(=CC=C4)I

InChI

InChI=1S/C23H16IN3O3S/c24-16-7-3-6-15(11-16)21(28)27-23(31)26-18-9-4-8-17(13-18)25-22(29)20-12-14-5-1-2-10-19(14)30-20/h1-13H,(H,25,29)(H2,26,27,28,31)