2-tert-butyl-3-iodanyl-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine

Systemtic Name: 2-tert-butyl-3-iodanyl-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Openeye Name: 2-tert-butyl-3-iodo-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine CAS Name: 2-tert-butyl-3-iodo-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine IUPAC Name: 2-tert-butyl-3-iodo-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Traditional Name: 2-tert-butyl-3-iodo-7-methoxy-5-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine Formula: C12H13F3IN3O MolecularWeight: 399.1508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN2C(=CC(=NC2=C1I)C(F)(F)F)OC

Isomeric SMILES

CC(C)(C)C1=NN2C(=CC(=NC2=C1I)C(F)(F)F)OC

InChI

InChI=1S/C12H13F3IN3O/c1-11(2,3)9-8(16)10-17-6(12(13,14)15)5-7(20-4)19(10)18-9/h5H,1-4H3