5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfonylmethyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfonylmethyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfonylmethyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfonylmethyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfonylmethyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[(4-tert-butyl-2,6-dimethyl-benzyl)sulfonylmethyl]-3-phenyl-1,2,4-oxadiazole Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CS(=O)(=O)CC2=NC(=NO2)C3=CC=CC=C3)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CS(=O)(=O)CC2=NC(=NO2)C3=CC=CC=C3)C)C(C)(C)C

InChI

InChI=1S/C22H26N2O3S/c1-15-11-18(22(3,4)5)12-16(2)19(15)13-28(25,26)14-20-23-21(24-27-20)17-9-7-6-8-10-17/h6-12H,13-14H2,1-5H3