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Name: THZ2 CAS#: 1604810-84-5 Chemical Formula: C31H28ClN7O2 Exact Mass: 565.1993 Molecular Weight: 566.06 Elemental Analysis: C, 65.78; H, 4.99; Cl, 6.26; N, 17.32; O, 5.65 |
Technical Information |
Synonym: THZ2; THZ 2; THZ-2. IUPAC/Chemical Name: N-[3-[[5-chloro-4-(1H-indol-3-yl)pyrimidin-2-yl]amino]phenyl]-3-[[(E)-4-(dimethylamino)but-2-enoyl]amino]benzamide InChi Key: FONRCZUZCHXWBD-VGOFMYFVSA-N InChi Code: InChI=1S/C31H28ClN7O2/c1-39(2)15-7-14-28(40)35-21-9-5-8-20(16-21)30(41)36-22-10-6-11-23(17-22)37-31-34-19-26(32)29(38-31)25-18-33-27-13-4-3-12-24(25)27/h3-14, 16-19, 33H, 15H2, 1-2H3, (H, 35, 40)(H, 36, 41)(H, 34, 37, 38)/b14-7+ SMILES Code: O=C(NC1=CC=CC(NC2=NC=C(Cl)C(C3=CNC4=C3C=CC=C4)=N2)=C1)C5=CC=CC(NC(/C=C/CN(C)C)=O)=C5 |