4-(5,7-ditert-butyl-6-methyl-2-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)phenol

Systemtic Name: 4-(5,7-ditert-butyl-6-methyl-2-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)phenol Openeye Name: 4-(5,7-ditert-butyl-6-methyl-2-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)phenol CAS Name: 4-(5,7-ditert-butyl-6-methyl-2-phenyl-3-pyrazolo[1,5-a]pyrimidinyl)phenol IUPAC Name: 4-(5,7-ditert-butyl-6-methyl-2-phenylpyrazolo[1,5-a]pyrimidin-3-yl)phenol Traditional Name: 4-(5,7-ditert-butyl-6-methyl-2-phenyl-pyrazolo[1,5-a]pyrimidin-3-yl)phenol Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)O)N=C1C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=C(N2C(=C(C(=N2)C3=CC=CC=C3)C4=CC=C(C=C4)O)N=C1C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H31N3O/c1-17-23(26(2,3)4)28-25-21(18-13-15-20(31)16-14-18)22(19-11-9-8-10-12-19)29-30(25)24(17)27(5,6)7/h8-16,31H,1-7H3