N-[3-[(2-iodanylphenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(2-iodanylphenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[3-[(2-iodobenzoyl)carbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(2-iodophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[3-[(2-iodobenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[3-[(2-iodobenzoyl)thiocarbamoylamino]-4-methoxy-phenyl]-2-furamide Formula: C20H16IN3O4S MolecularWeight: 521.32821

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=S)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC=CO2)NC(=S)NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H16IN3O4S/c1-27-16-9-8-12(22-19(26)17-7-4-10-28-17)11-15(16)23-20(29)24-18(25)13-5-2-3-6-14(13)21/h2-11H,1H3,(H,22,26)(H2,23,24,25,29)