2-isothiocyanatobenzenethiol

Systemtic Name: 2-isothiocyanatobenzenethiol Openeye Name: 2-isothiocyanatobenzenethiol CAS Name: 2-isothiocyanatobenzenethiol IUPAC Name: 2-isothiocyanatobenzenethiol Traditional Name: 2-isothiocyanatobenzenethiol Formula: C7H5NS2 MolecularWeight: 167.2513

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N=C=S)S

Isomeric SMILES

C1=CC=C(C(=C1)N=C=S)S

InChI

InChI=1S/C7H5NS2/c9-5-8-6-3-1-2-4-7(6)10/h1-4,10H