4-[3-(2-tert-butylphenoxy)-2-oxidanyl-propyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 4-[3-(2-tert-butylphenoxy)-2-oxidanyl-propyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 4-[3-(2-tert-butylphenoxy)-2-hydroxy-propyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 4-[3-(2-tert-butylphenoxy)-2-hydroxypropyl]-2,5-dimethyl-7-pyrazolo[1,5-a]pyrimidinone IUPAC Name: 4-[3-(2-tert-butylphenoxy)-2-hydroxypropyl]-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 4-[3-(2-tert-butylphenoxy)-2-hydroxy-propyl]-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-one Formula: C21H27N3O3 MolecularWeight: 369.45738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=CC(=N2)C)N1CC(COC3=CC=CC=C3C(C)(C)C)O

Isomeric SMILES

CC1=CC(=O)N2C(=CC(=N2)C)N1CC(COC3=CC=CC=C3C(C)(C)C)O

InChI

InChI=1S/C21H27N3O3/c1-14-10-19-23(15(2)11-20(26)24(19)22-14)12-16(25)13-27-18-9-7-6-8-17(18)21(3,4)5/h6-11,16,25H,12-13H2,1-5H3