1,3-bis(chloranyl)-2-(4-nitro-3-propan-2-ylsulfanyl-phenyl)-5-(trifluoromethyl)benzene

Systemtic Name: 1,3-bis(chloranyl)-2-(4-nitro-3-propan-2-ylsulfanyl-phenyl)-5-(trifluoromethyl)benzene Openeye Name: 1,3-dichloro-2-(3-isopropylsulfanyl-4-nitro-phenyl)-5-(trifluoromethyl)benzene CAS Name: 1,3-dichloro-2-[4-nitro-3-(propan-2-ylthio)phenyl]-5-(trifluoromethyl)benzene IUPAC Name: 1,3-dichloro-2-(4-nitro-3-propan-2-ylsulfanylphenyl)-5-(trifluoromethyl)benzene Traditional Name: 1,3-dichloro-2-[3-(isopropylthio)-4-nitro-phenyl]-5-(trifluoromethyl)benzene Formula: C16H12Cl2F3NO2S MolecularWeight: 410.23819

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=C(C=CC(=C1)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)SC1=C(C=CC(=C1)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12Cl2F3NO2S/c1-8(2)25-14-5-9(3-4-13(14)22(23)24)15-11(17)6-10(7-12(15)18)16(19,20)21/h3-8H,1-2H3