[(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-oxidanylidene-propyl] morpholine-4-carbodithioate

Systemtic Name: [(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-oxidanylidene-propyl] morpholine-4-carbodithioate Openeye Name: [(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-oxo-propyl] morpholine-4-carbodithioate CAS Name: 4-morpholinecarbodithioic acid [(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-oxopropyl] ester IUPAC Name: [(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-oxopropyl] morpholine-4-carbodithioate Traditional Name: morpholine-4-carbodithioic acid [(3R)-3-(1H-benzimidazol-2-yl)-3-cyano-2-keto-propyl] ester Formula: C16H16N4O2S2 MolecularWeight: 360.45384

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=S)SCC(=O)C(C#N)C2=NC3=CC=CC=C3N2

Isomeric SMILES

C1COCCN1C(=S)SCC(=O)[C@H](C#N)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H16N4O2S2/c17-9-11(15-18-12-3-1-2-4-13(12)19-15)14(21)10-24-16(23)20-5-7-22-8-6-20/h1-4,11H,5-8,10H2,(H,18,19)/t11-/m0/s1