(5S)-3-[3,5-bis(chloranyl)-2,4,6-trimethyl-phenyl]-5-(fluoranylmethyl)-5-[(4-methylphenyl)sulfinylmethyl]-4H-1,2-oxazole

Systemtic Name: (5S)-3-[3,5-bis(chloranyl)-2,4,6-trimethyl-phenyl]-5-(fluoranylmethyl)-5-[(4-methylphenyl)sulfinylmethyl]-4H-1,2-oxazole Openeye Name: (5S)-3-(3,5-dichloro-2,4,6-trimethyl-phenyl)-5-(fluoromethyl)-5-(p-tolylsulfinylmethyl)-4H-isoxazole CAS Name: (5S)-3-(3,5-dichloro-2,4,6-trimethylphenyl)-5-(fluoromethyl)-5-[(4-methylphenyl)sulfinylmethyl]-4H-isoxazole IUPAC Name: (5S)-3-(3,5-dichloro-2,4,6-trimethylphenyl)-5-(fluoromethyl)-5-[(4-methylphenyl)sulfinylmethyl]-4H-1,2-oxazole Traditional Name: (5S)-3-(3,5-dichloro-2,4,6-trimethyl-phenyl)-5-(fluoromethyl)-5-(p-tolylsulfinylmethyl)-2-isoxazoline Formula: C21H22Cl2FNO2S MolecularWeight: 442.374283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)CC2(CC(=NO2)C3=C(C(=C(C(=C3C)Cl)C)Cl)C)CF

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)C[C@]2(CC(=NO2)C3=C(C(=C(C(=C3C)Cl)C)Cl)C)CF

InChI

InChI=1S/C21H22Cl2FNO2S/c1-12-5-7-16(8-6-12)28(26)11-21(10-24)9-17(25-27-21)18-13(2)19(22)15(4)20(23)14(18)3/h5-8H,9-11H2,1-4H3/t21-,28?/m0/s1