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3-(1H-benzimidazol-2-ylsulfanyl)pentane-2,4-dione

3-(1H-benzimidazol-2-ylsulfanyl)pentane-2,4-dione

Systemtic Name:3-(1H-benzimidazol-2-ylsulfanyl)pentane-2,4-dione
Openeye Name:3-(1H-benzimidazol-2-ylsulfanyl)pentane-2,4-dione
CAS Name:3-(1H-benzimidazol-2-ylthio)pentane-2,4-dione
IUPAC Name:3-(1H-benzimidazol-2-ylsulfanyl)pentane-2,4-dione
Traditional Name:3-(1H-benzimidazol-2-ylthio)pentane-2,4-dione
Formula: C12H12N2O2S
MolecularWeight: 248.30088
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)C)SC1=NC2=CC=CC=C2N1


Isomeric SMILES

CC(=O)C(C(=O)C)SC1=NC2=CC=CC=C2N1


InChI

InChI=1S/C12H12N2O2S/c1-7(15)11(8(2)16)17-12-13-9-5-3-4-6-10(9)14-12/h3-6,11H,1-2H3,(H,13,14)


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