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

Systemtic Name: S-(thiiran-2-ylmethyl) 4-pyrimidin-2-ylpiperazine-1-carbothioate Openeye Name: S-(thiiran-2-ylmethyl) 4-pyrimidin-2-ylpiperazine-1-carbothioate CAS Name: 4-(2-pyrimidinyl)-1-piperazinecarbothioic acid S-(2-thiiranylmethyl) ester IUPAC Name: S-(thiiran-2-ylmethyl) 4-pyrimidin-2-ylpiperazine-1-carbothioate Traditional Name: 4-(2-pyrimidyl)piperazine-1-carbothioic acid S-(thiiran-2-ylmethyl) ester Formula: C12H16N4OS2 MolecularWeight: 296.41164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N4OS2/c17-12(19-9-10-8-18-10)16-6-4-15(5-7-16)11-13-2-1-3-14-11/h1-3,10H,4-9H2