2-(2-oxidanylidenepyrrolidin-1-yl)ethyl azepane-1-carbodithioate

Systemtic Name: 2-(2-oxidanylidenepyrrolidin-1-yl)ethyl azepane-1-carbodithioate Openeye Name: 2-(2-oxopyrrolidin-1-yl)ethyl azepane-1-carbodithioate CAS Name: 1-azepanecarbodithioic acid 2-(2-oxo-1-pyrrolidinyl)ethyl ester IUPAC Name: 2-(2-oxopyrrolidin-1-yl)ethyl azepane-1-carbodithioate Traditional Name: azepane-1-carbodithioic acid 2-(2-ketopyrrolidino)ethyl ester Formula: C13H22N2OS2 MolecularWeight: 286.45658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)SCCN2CCCC2=O

Isomeric SMILES

C1CCCN(CC1)C(=S)SCCN2CCCC2=O

InChI

InChI=1S/C13H22N2OS2/c16-12-6-5-9-14(12)10-11-18-13(17)15-7-3-1-2-4-8-15/h1-11H2