3-isothiocyanatoprop-1-en-2-ylsulfonylbenzene

Systemtic Name: 3-isothiocyanatoprop-1-en-2-ylsulfonylbenzene Openeye Name: 1-(isothiocyanatomethyl)vinylsulfonylbenzene CAS Name: 3-isothiocyanatoprop-1-en-2-ylsulfonylbenzene IUPAC Name: 3-isothiocyanatoprop-1-en-2-ylsulfonylbenzene Traditional Name: 1-(isothiocyanatomethyl)vinylsulfonylbenzene Formula: C10H9NO2S2 MolecularWeight: 239.31396

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Descriptors Computed from Structure

Canonical SMILES:

C=C(CN=C=S)S(=O)(=O)C1=CC=CC=C1

Isomeric SMILES

C=C(CN=C=S)S(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C10H9NO2S2/c1-9(7-11-8-14)15(12,13)10-5-3-2-4-6-10/h2-6H,1,7H2