2-isothiocyanatoethyl 3-azabicyclo[3.2.2]nonane-3-carbodithioate

Systemtic Name: 2-isothiocyanatoethyl 3-azabicyclo[3.2.2]nonane-3-carbodithioate Openeye Name: 2-isothiocyanatoethyl 3-azabicyclo[3.2.2]nonane-3-carbodithioate CAS Name: 3-azabicyclo[3.2.2]nonane-3-carbodithioic acid 2-isothiocyanatoethyl ester IUPAC Name: 2-isothiocyanatoethyl 3-azabicyclo[3.2.2]nonane-3-carbodithioate Traditional Name: 3-azabicyclo[3.2.2]nonane-3-carbodithioic acid 2-isothiocyanatoethyl ester Formula: C12H18N2S3 MolecularWeight: 286.47972

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CCC1CN(C2)C(=S)SCCN=C=S

Isomeric SMILES

C1CC2CCC1CN(C2)C(=S)SCCN=C=S

InChI

InChI=1S/C12H18N2S3/c15-9-13-5-6-17-12(16)14-7-10-1-2-11(8-14)4-3-10/h10-11H,1-8H2