N-[3-[(2-chloranyl-5-iodanyl-phenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide

Systemtic Name: N-[3-[(2-chloranyl-5-iodanyl-phenyl)carbonylcarbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide Openeye Name: N-[3-[(2-chloro-5-iodo-benzoyl)carbamothioylamino]-4-methoxy-phenyl]furan-2-carboxamide CAS Name: N-[3-[[[[(2-chloro-5-iodophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-methoxyphenyl]-2-furancarboxamide IUPAC Name: N-[3-[(2-chloro-5-iodobenzoyl)carbamothioylamino]-4-methoxyphenyl]furan-2-carboxamide Traditional Name: N-[3-[(2-chloro-5-iodo-benzoyl)thiocarbamoylamino]-4-methoxy-phenyl]-2-furamide Formula: C20H15ClIN3O4S MolecularWeight: 555.77327

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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=C(C=CC(=C3)I)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClIN3O4S/c1-28-16-7-5-12(23-19(27)17-3-2-8-29-17)10-15(16)24-20(30)25-18(26)13-9-11(22)4-6-14(13)21/h2-10H,1H3,(H,23,27)(H2,24,25,26,30)