1-[2-(2-oxidanylidenepropylsulfanyl)benzimidazol-1-yl]propan-2-one

Systemtic Name: 1-[2-(2-oxidanylidenepropylsulfanyl)benzimidazol-1-yl]propan-2-one Openeye Name: 1-(2-acetonylsulfanylbenzimidazol-1-yl)propan-2-one CAS Name: 1-[2-(2-oxopropylthio)-1-benzimidazolyl]-2-propanone IUPAC Name: 1-[2-(2-oxopropylsulfanyl)benzimidazol-1-yl]propan-2-one Traditional Name: 1-[2-(acetonylthio)benzimidazol-1-yl]acetone Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)C

Isomeric SMILES

CC(=O)CN1C2=CC=CC=C2N=C1SCC(=O)C

InChI

InChI=1S/C13H14N2O2S/c1-9(16)7-15-12-6-4-3-5-11(12)14-13(15)18-8-10(2)17/h3-6H,7-8H2,1-2H3