2-chloranyl-3-[chloranyl-bis(fluoranyl)methyl]-6-isocyanato-benzenethiol

Systemtic Name: 2-chloranyl-3-[chloranyl-bis(fluoranyl)methyl]-6-isocyanato-benzenethiol Openeye Name: 2-chloro-3-[chloro(difluoro)methyl]-6-isocyanato-benzenethiol CAS Name: 2-chloro-3-[chloro(difluoro)methyl]-6-isocyanatobenzenethiol IUPAC Name: 2-chloro-3-[chloro(difluoro)methyl]-6-isocyanatobenzenethiol Traditional Name: 2-chloro-3-[chloro(difluoro)methyl]-6-isocyanato-benzenethiol Formula: C8H3Cl2F2NOS MolecularWeight: 270.083326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C(F)(F)Cl)Cl)S)N=C=O

Isomeric SMILES

C1=CC(=C(C(=C1C(F)(F)Cl)Cl)S)N=C=O

InChI

InChI=1S/C8H3Cl2F2NOS/c9-6-4(8(10,11)12)1-2-5(7(6)15)13-3-14/h1-2,15H