3-[(4-propan-2-ylphenyl)sulfonylmethyl]-5-(trifluoromethyl)-1,2,4-oxadiazole

Systemtic Name: 3-[(4-propan-2-ylphenyl)sulfonylmethyl]-5-(trifluoromethyl)-1,2,4-oxadiazole Openeye Name: 3-[(4-isopropylphenyl)sulfonylmethyl]-5-(trifluoromethyl)-1,2,4-oxadiazole CAS Name: 3-[(4-propan-2-ylphenyl)sulfonylmethyl]-5-(trifluoromethyl)-1,2,4-oxadiazole IUPAC Name: 3-[(4-propan-2-ylphenyl)sulfonylmethyl]-5-(trifluoromethyl)-1,2,4-oxadiazole Traditional Name: 3-(p-cumenylsulfonylmethyl)-5-(trifluoromethyl)-1,2,4-oxadiazole Formula: C13H13F3N2O3S MolecularWeight: 334.31413

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)CC2=NOC(=N2)C(F)(F)F

InChI

InChI=1S/C13H13F3N2O3S/c1-8(2)9-3-5-10(6-4-9)22(19,20)7-11-17-12(21-18-11)13(14,15)16/h3-6,8H,7H2,1-2H3