CAS
24502-78-1 Purity
98%
24502-78-1 Purity
98%
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Etravirine
CAS
269055-15-4
Catalog Number
ACM269055154
Category
Inhibitors
Molecular Weight
435.3
Molecular Formula
C20H15BrN6O
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Specification
Description
Etravirine is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used for the treatment of HIV.
Synonyms
TMC-125
IUPAC Name
4-[6-amino-5-bromo-2-(4-cyanoanilino)pyrimidin-4-yl]oxy-3,5-dimethylbenzonitrile
Canonical SMILES
CC1=CC(=CC(=C1OC2=NC(=NC(=C2Br)N)NC3=CC=C(C=C3)C#N)C)C#N
InChI
InChI=1S/C20H15BrN6O/c1-11-7-14(10-23)8-12(2)17(11)28-19-16(21)18(24)26-20(27-19)25-15-5-3-13(9-22)4-6-15/h3-8H,1-2H3,(H3,24,25,26,27)
InChI Key
PYGWGZALEOIKDF-UHFFFAOYSA-N
Boiling Point
637.4±65.0 ºC
Melting Point
265 ºC
Density
1.439 g/ml
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