1-[chloranyl-bis(fluoranyl)methyl]sulfanyl-3-isocyanato-benzene

Systemtic Name: 1-[chloranyl-bis(fluoranyl)methyl]sulfanyl-3-isocyanato-benzene Openeye Name: 1-[chloro(difluoro)methyl]sulfanyl-3-isocyanato-benzene CAS Name: 1-[[chloro(difluoro)methyl]thio]-3-isocyanatobenzene IUPAC Name: 1-[chloro(difluoro)methyl]sulfanyl-3-isocyanatobenzene Traditional Name: 1-[[chloro(difluoro)methyl]thio]-3-isocyanato-benzene Formula: C8H4ClF2NOS MolecularWeight: 235.638266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC(F)(F)Cl)N=C=O

Isomeric SMILES

C1=CC(=CC(=C1)SC(F)(F)Cl)N=C=O

InChI

InChI=1S/C8H4ClF2NOS/c9-8(10,11)14-7-3-1-2-6(4-7)12-5-13/h1-4H