1,2,3-tris(chloranyl)-4-isothiocyanato-butane

Systemtic Name: 1,2,3-tris(chloranyl)-4-isothiocyanato-butane Openeye Name: 1,2,3-trichloro-4-isothiocyanato-butane CAS Name: 1,2,3-trichloro-4-isothiocyanatobutane IUPAC Name: 1,2,3-trichloro-4-isothiocyanatobutane Traditional Name: 1,2,3-trichloro-4-isothiocyanato-butane Formula: C5H6Cl3NS MolecularWeight: 218.53184

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(CCl)Cl)Cl)N=C=S

Isomeric SMILES

C(C(C(CCl)Cl)Cl)N=C=S

InChI

InChI=1S/C5H6Cl3NS/c6-1-4(7)5(8)2-9-3-10/h4-5H,1-2H2