S-(thiiran-2-ylmethyl) 4-pyridin-2-ylpiperazine-1-carbothioate

Systemtic Name: S-(thiiran-2-ylmethyl) 4-pyridin-2-ylpiperazine-1-carbothioate Openeye Name: S-(thiiran-2-ylmethyl) 4-(2-pyridyl)piperazine-1-carbothioate CAS Name: 4-(2-pyridinyl)-1-piperazinecarbothioic acid S-(2-thiiranylmethyl) ester IUPAC Name: S-(thiiran-2-ylmethyl) 4-pyridin-2-ylpiperazine-1-carbothioate Traditional Name: 4-(2-pyridyl)piperazine-1-carbothioic acid S-(thiiran-2-ylmethyl) ester Formula: C13H17N3OS2 MolecularWeight: 295.42358

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)SCC3CS3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)SCC3CS3

InChI

InChI=1S/C13H17N3OS2/c17-13(19-10-11-9-18-11)16-7-5-15(6-8-16)12-3-1-2-4-14-12/h1-4,11H,5-10H2