tert-butyl N-(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)carbamate

Systemtic Name: tert-butyl N-(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)carbamate Openeye Name: tert-butyl N-(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)carbamate CAS Name: N-(3-bromo-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(3-bromo-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)carbamate Traditional Name: N-(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)carbamic acid tert-butyl ester Formula: C17H17BrN4O2 MolecularWeight: 389.24648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=NC2=C(C=NN12)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=NC2=C(C=NN12)Br)C3=CC=CC=C3

InChI

InChI=1S/C17H17BrN4O2/c1-17(2,3)24-16(23)21-14-9-13(11-7-5-4-6-8-11)20-15-12(18)10-19-22(14)15/h4-10H,1-3H3,(H,21,23)