4-isothiocyanatobut-2-ynyl thiocyanate

Systemtic Name: 4-isothiocyanatobut-2-ynyl thiocyanate Openeye Name: 4-isothiocyanatobut-2-ynyl thiocyanate CAS Name: thiocyanic acid 4-isothiocyanatobut-2-ynyl ester IUPAC Name: 4-isothiocyanatobut-2-ynyl thiocyanate Traditional Name: thiocyanic acid 4-isothiocyanatobut-2-ynyl ester Formula: C6H4N2S2 MolecularWeight: 168.23936

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Descriptors Computed from Structure

Canonical SMILES:

C(C#CCSC#N)N=C=S

Isomeric SMILES

C(C#CCSC#N)N=C=S

InChI

InChI=1S/C6H4N2S2/c7-5-10-4-2-1-3-8-6-9/h3-4H2