2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(thiophen-2-ylmethylsulfanyl)propan-2-ol

Systemtic Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(thiophen-2-ylmethylsulfanyl)propan-2-ol Openeye Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(2-thienylmethylsulfanyl)propan-2-ol CAS Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(thiophen-2-ylmethylthio)-2-propanol IUPAC Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(thiophen-2-ylmethylsulfanyl)propan-2-ol Traditional Name: 2-[5-nitro-6-(trifluoromethyl)-1H-indol-2-yl]-1-(2-thenylthio)propan-2-ol Formula: C17H15F3N2O3S2 MolecularWeight: 416.43781

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC1=CC=CS1)(C2=CC3=CC(=C(C=C3N2)C(F)(F)F)[N+](=O)[O-])O

Isomeric SMILES

CC(CSCC1=CC=CS1)(C2=CC3=CC(=C(C=C3N2)C(F)(F)F)[N+](=O)[O-])O

InChI

InChI=1S/C17H15F3N2O3S2/c1-16(23,9-26-8-11-3-2-4-27-11)15-6-10-5-14(22(24)25)12(17(18,19)20)7-13(10)21-15/h2-7,21,23H,8-9H2,1H3