5-bromanyl-N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2,2,2-tris(chloranyl)-1-(naphthalen-1-ylcarbamothioylamino)ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2,2,2-trichloro-1-(1-naphthylcarbamothioylamino)ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[2,2,2-trichloro-1-[[(1-naphthalenylamino)-sulfanylidenemethyl]amino]ethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[2,2,2-trichloro-1-(naphthalen-1-ylcarbamothioylamino)ethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[2,2,2-trichloro-1-(1-naphthylthiocarbamoylamino)ethyl]-2-furamide Formula: C18H13BrCl3N3O2S MolecularWeight: 521.64272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2NC(=S)NC(C(Cl)(Cl)Cl)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C18H13BrCl3N3O2S/c19-14-9-8-13(27-14)15(26)24-16(18(20,21)22)25-17(28)23-12-7-3-5-10-4-1-2-6-11(10)12/h1-9,16H,(H,24,26)(H2,23,25,28)