N-[2,2,2-tris(chloranyl)-1-(1,2,4-triazol-4-ylcarbamothioylamino)ethyl]furan-2-carboxamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-(1,2,4-triazol-4-ylcarbamothioylamino)ethyl]furan-2-carboxamide Openeye Name: N-[2,2,2-trichloro-1-(1,2,4-triazol-4-ylcarbamothioylamino)ethyl]furan-2-carboxamide CAS Name: N-[2,2,2-trichloro-1-[[sulfanylidene-(1,2,4-triazol-4-ylamino)methyl]amino]ethyl]-2-furancarboxamide IUPAC Name: N-[2,2,2-trichloro-1-(1,2,4-triazol-4-ylcarbamothioylamino)ethyl]furan-2-carboxamide Traditional Name: N-[2,2,2-trichloro-1-(1,2,4-triazol-4-ylthiocarbamoylamino)ethyl]-2-furamide Formula: C10H9Cl3N6O2S MolecularWeight: 383.64146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NN2C=NN=C2

Isomeric SMILES

C1=COC(=C1)C(=O)NC(C(Cl)(Cl)Cl)NC(=S)NN2C=NN=C2

InChI

InChI=1S/C10H9Cl3N6O2S/c11-10(12,13)8(16-7(20)6-2-1-3-21-6)17-9(22)18-19-4-14-15-5-19/h1-5,8H,(H,16,20)(H2,17,18,22)