N-[2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]octadecanamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-isothiocyanato-ethyl]octadecanamide Openeye Name: N-(2,2,2-trichloro-1-isothiocyanato-ethyl)octadecanamide CAS Name: N-(2,2,2-trichloro-1-isothiocyanatoethyl)octadecanamide IUPAC Name: N-(2,2,2-trichloro-1-isothiocyanatoethyl)octadecanamide Traditional Name: N-(2,2,2-trichloro-1-isothiocyanato-ethyl)stearamide Formula: C21H37Cl3N2OS MolecularWeight: 471.95528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(C(Cl)(Cl)Cl)N=C=S

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(C(Cl)(Cl)Cl)N=C=S

InChI

InChI=1S/C21H37Cl3N2OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19(27)26-20(25-18-28)21(22,23)24/h20H,2-17H2,1H3,(H,26,27)