3-tert-butyl-6-(4-methylsulfonylphenyl)-7-phenyl-pyrazolo[5,1-b][1,3]oxazole

Systemtic Name: 3-tert-butyl-6-(4-methylsulfonylphenyl)-7-phenyl-pyrazolo[5,1-b][1,3]oxazole Openeye Name: 3-tert-butyl-6-(4-methylsulfonylphenyl)-7-phenyl-pyrazolo[5,1-b]oxazole CAS Name: 3-tert-butyl-6-(4-methylsulfonylphenyl)-7-phenylpyrazolo[5,1-b]oxazole IUPAC Name: 3-tert-butyl-6-(4-methylsulfonylphenyl)-7-phenylpyrazolo[5,1-b][1,3]oxazole Traditional Name: 3-tert-butyl-6-(4-mesylphenyl)-7-phenyl-pyrazolo[5,1-b]oxazole Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=COC2=C(C(=NN12)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=COC2=C(C(=NN12)C3=CC=C(C=C3)S(=O)(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2O3S/c1-22(2,3)18-14-27-21-19(15-8-6-5-7-9-15)20(23-24(18)21)16-10-12-17(13-11-16)28(4,25)26/h5-14H,1-4H3