(3-chloranyl-2-oxidanyl-propyl) 4-pyrimidin-2-ylpiperazine-1-carbodithioate

Systemtic Name: (3-chloranyl-2-oxidanyl-propyl) 4-pyrimidin-2-ylpiperazine-1-carbodithioate Openeye Name: (3-chloro-2-hydroxy-propyl) 4-pyrimidin-2-ylpiperazine-1-carbodithioate CAS Name: 4-(2-pyrimidinyl)-1-piperazinecarbodithioic acid (3-chloro-2-hydroxypropyl) ester IUPAC Name: (3-chloro-2-hydroxypropyl) 4-pyrimidin-2-ylpiperazine-1-carbodithioate Traditional Name: 4-(2-pyrimidyl)piperazine-1-carbodithioic acid (3-chloro-2-hydroxy-propyl) ester Formula: C12H17ClN4OS2 MolecularWeight: 332.87258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=S)SCC(CCl)O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=S)SCC(CCl)O

InChI

InChI=1S/C12H17ClN4OS2/c13-8-10(18)9-20-12(19)17-6-4-16(5-7-17)11-14-2-1-3-15-11/h1-3,10,18H,4-9H2