tert-butyl N-[2-[[4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]sulfonylamino]ethyl]carbamate

Systemtic Name: tert-butyl N-[2-[[4-[(3-bromanyl-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]sulfonylamino]ethyl]carbamate Openeye Name: tert-butyl N-[2-[[4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]sulfonylamino]ethyl]carbamate CAS Name: N-[2-[[4-[(3-bromo-5-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)amino]phenyl]sulfonylamino]ethyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-[[4-[(3-bromo-5-phenylpyrazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]sulfonylamino]ethyl]carbamate Traditional Name: N-[2-[[4-[(3-bromo-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)amino]phenyl]sulfonylamino]ethyl]carbamic acid tert-butyl ester Formula: C25H27BrN6O4S MolecularWeight: 587.48868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCNS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)NCCNS(=O)(=O)C1=CC=C(C=C1)NC2=CC(=NC3=C(C=NN23)Br)C4=CC=CC=C4

InChI

InChI=1S/C25H27BrN6O4S/c1-25(2,3)36-24(33)27-13-14-29-37(34,35)19-11-9-18(10-12-19)30-22-15-21(17-7-5-4-6-8-17)31-23-20(26)16-28-32(22)23/h4-12,15-16,29-30H,13-14H2,1-3H3,(H,27,33)