4-isothiocyanatobenzoyl bromide

Systemtic Name: 4-isothiocyanatobenzoyl bromide Openeye Name: 4-isothiocyanatobenzoyl bromide CAS Name: 4-isothiocyanatobenzoyl bromide IUPAC Name: 4-isothiocyanatobenzoyl bromide Traditional Name: 4-isothiocyanatobenzoyl bromide Formula: C8H4BrNOS MolecularWeight: 242.09246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)Br)N=C=S

Isomeric SMILES

C1=CC(=CC=C1C(=O)Br)N=C=S

InChI

InChI=1S/C8H4BrNOS/c9-8(11)6-1-3-7(4-2-6)10-5-12/h1-4H