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

Systemtic Name: tert-butyl N-(5-chloranyl-3-iodanyl-pyrazolo[1,5-a]pyrimidin-7-yl)carbamate Openeye Name: tert-butyl N-(5-chloro-3-iodo-pyrazolo[1,5-a]pyrimidin-7-yl)carbamate CAS Name: N-(5-chloro-3-iodo-7-pyrazolo[1,5-a]pyrimidinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(5-chloro-3-iodopyrazolo[1,5-a]pyrimidin-7-yl)carbamate Traditional Name: N-(5-chloro-3-iodo-pyrazolo[1,5-a]pyrimidin-7-yl)carbamic acid tert-butyl ester Formula: C11H12ClIN4O2 MolecularWeight: 394.59605

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC(=NC2=C(C=NN12)I)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC(=NC2=C(C=NN12)I)Cl

InChI

InChI=1S/C11H12ClIN4O2/c1-11(2,3)19-10(18)16-8-4-7(12)15-9-6(13)5-14-17(8)9/h4-5H,1-3H3,(H,16,18)