1-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-(2-oxidanylidenepropylsulfanyl)propyl]sulfanylpropan-2-one

Systemtic Name: 1-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-(2-oxidanylidenepropylsulfanyl)propyl]sulfanylpropan-2-one Openeye Name: 1-[2-acetonylsulfanyl-3-(1,3-benzothiazol-2-ylsulfanyl)propyl]sulfanylpropan-2-one CAS Name: 1-[[3-(1,3-benzothiazol-2-ylthio)-2-(2-oxopropylthio)propyl]thio]-2-propanone IUPAC Name: 1-[3-(1,3-benzothiazol-2-ylsulfanyl)-2-(2-oxopropylsulfanyl)propyl]sulfanylpropan-2-one Traditional Name: 1-[[2-(acetonylthio)-3-(1,3-benzothiazol-2-ylthio)propyl]thio]acetone Formula: C16H19NO2S4 MolecularWeight: 385.58756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSCC(CSC1=NC2=CC=CC=C2S1)SCC(=O)C

Isomeric SMILES

CC(=O)CSCC(CSC1=NC2=CC=CC=C2S1)SCC(=O)C

InChI

InChI=1S/C16H19NO2S4/c1-11(18)7-20-9-13(21-8-12(2)19)10-22-16-17-14-5-3-4-6-15(14)23-16/h3-6,13H,7-10H2,1-2H3