5-[(2,5-dimethylphenyl)methylsulfonylmethyl]-3-(2-methylpropyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(2,5-dimethylphenyl)methylsulfonylmethyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Openeye Name: 5-[(2,5-dimethylphenyl)methylsulfonylmethyl]-3-isobutyl-1,2,4-oxadiazole CAS Name: 5-[(2,5-dimethylphenyl)methylsulfonylmethyl]-3-(2-methylpropyl)-1,2,4-oxadiazole IUPAC Name: 5-[(2,5-dimethylphenyl)methylsulfonylmethyl]-3-(2-methylpropyl)-1,2,4-oxadiazole Traditional Name: 5-[(2,5-dimethylbenzyl)sulfonylmethyl]-3-isobutyl-1,2,4-oxadiazole Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CS(=O)(=O)CC2=NC(=NO2)CC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CS(=O)(=O)CC2=NC(=NO2)CC(C)C

InChI

InChI=1S/C16H22N2O3S/c1-11(2)7-15-17-16(21-18-15)10-22(19,20)9-14-8-12(3)5-6-13(14)4/h5-6,8,11H,7,9-10H2,1-4H3