CAS Registry Number: 761440-16-8

Name:

4-​Pyrimidinamine, 2,​5-​dichloro-​N-​[2-​[(1-​methylethyl)​sulfonyl]​phenyl]​-
(2,​5-​Dichloropyrimidin-​4-​yl)​[2-​[(propan-​2-​yl)​sulfonyl]​phenyl]​amine; 2,​5-​Dichloro-​N-​[2-​(isopropylsulfonyl)​phenyl]​pyrimidin-​4-​amine 

Chemical Formula: C13H13Cl2N3O2S
Exact Mass: 345.01
Molecular Weight: 346.23
m/z: 345.01 (100.0%), 347.01 (69.1%), 346.01 (16.0%), 349.00 (13.1%), 348.01 (10.3%), 350.01 (1.9%), 349.01 (1.1%)

InChI: InChI=1S/C13H13Cl2N3O2S/c1-8(2)21(19,20)11-6-4-3-5-10(11)17-12-9(14)7-16-13(15)18-12/h3-8H,1-2H3,(H,16,17,18)
InChIKey: WWVLDJAVSQZSKO-UHFFFAOYSA-N
Canonical SMILES : CC(C)S(=O)(=O)C1=CC=CC=C1NC2=NC(=NC=C2Cl)Cl

Specification

98%

PCT Int. Appl. (2012), WO 2012082972 A1 20120621. 

PCT Int. Appl. (2011), WO 2011140338 A1 20111110.