Etravirine D4
[CAS# 1142095-93-9]

Identification

• Name: Etravirine D4
• Synonyms: Etravirine D4; HY-90005S; CS-O-06604; HY 90005S; CS O-06604; HY90005S
• Molecular Formula: C₂₀H₁₅BrN₆O
• Molecular Weight: 439.30
• CAS Registry Number: 1142095-93-9
• SMILES: CC1=CC(=CC(=C1OC2=NC(=NC(=C2Br)N)NC3=CC=C(C=C3)C#N)C)C#N
• 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)/i3D,4D,5D,6D
• InChIKey: PYGWGZALEOIKDF-LNFUJOGGSA-N

Properties

• solubility: 10 mM in DMSO