N-[2,2,2-tris(chloranyl)-1-[(4-iodophenyl)carbamothioylamino]ethyl]furan-2-carboxamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-[(4-iodophenyl)carbamothioylamino]ethyl]furan-2-carboxamide Openeye Name: N-[2,2,2-trichloro-1-[(4-iodophenyl)carbamothioylamino]ethyl]furan-2-carboxamide CAS Name: N-[2,2,2-trichloro-1-[[(4-iodoanilino)-sulfanylidenemethyl]amino]ethyl]-2-furancarboxamide IUPAC Name: N-[2,2,2-trichloro-1-[(4-iodophenyl)carbamothioylamino]ethyl]furan-2-carboxamide Traditional Name: N-[2,2,2-trichloro-1-[(4-iodophenyl)thiocarbamoylamino]ethyl]-2-furamide Formula: C14H11Cl3IN3O2S MolecularWeight: 518.58451

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)I

Isomeric SMILES

C1=COC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC2=CC=C(C=C2)I

InChI

InChI=1S/C14H11Cl3IN3O2S/c15-14(16,17)12(20-11(22)10-2-1-7-23-10)21-13(24)19-9-5-3-8(18)4-6-9/h1-7,12H,(H,20,22)(H2,19,21,24)