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2-ethylsulfanyl-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol

2-ethylsulfanyl-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol

Systemtic Name:2-ethylsulfanyl-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol
Openeye Name:2-ethylsulfanyl-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol
CAS Name:2-(ethylthio)-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)-2-indolyl]ethanol
IUPAC Name:2-ethylsulfanyl-1-[1-methylsulfonyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol
Traditional Name:2-(ethylthio)-1-[1-mesyl-5-nitro-6-(trifluoromethyl)indol-2-yl]ethanol
Formula: C14H15F3N2O5S2
MolecularWeight: 412.40451
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Descriptors Computed from Structure

Canonical SMILES:

CCSCC(C1=CC2=CC(=C(C=C2N1S(=O)(=O)C)C(F)(F)F)[N+](=O)[O-])O


Isomeric SMILES

CCSCC(C1=CC2=CC(=C(C=C2N1S(=O)(=O)C)C(F)(F)F)[N+](=O)[O-])O


InChI

InChI=1S/C14H15F3N2O5S2/c1-3-25-7-13(20)12-5-8-4-11(19(21)22)9(14(15,16)17)6-10(8)18(12)26(2,23)24/h4-6,13,20H,3,7H2,1-2H3


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