3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one

Systemtic Name: 3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one Openeye Name: 3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one CAS Name: 3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one IUPAC Name: 3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one Traditional Name: 3-isocyanato-5-thia-1-azabicyclo[4.2.0]oct-3-en-8-one Formula: C7H6N2O2S MolecularWeight: 182.19974

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Descriptors Computed from Structure

Canonical SMILES:

C1C2N(C1=O)CC(=CS2)N=C=O

Isomeric SMILES

C1C2N(C1=O)CC(=CS2)N=C=O

InChI

InChI=1S/C7H6N2O2S/c10-4-8-5-2-9-6(11)1-7(9)12-3-5/h3,7H,1-2H2