CAS Registry Number®
1421373-66-1
CAS Name
2-Propenamide, N-[2-[[2-(dimethylamino)ethyl]methylamino]-4-methoxy-5-[[4-(1-methyl-1H-indol-3-yl)-2-pyrimidinyl]amino]phenyl]-, methanesulfonate (1:1)
Molecular Formula
C28H33N7O2.CH4O3S
Compound Properties
-
Melting Point (1)
246-259 °C
Source(s)
- (1) Finlay, M. Raymond V.; Journal of Medicinal Chemistry, (2014), 57(20), 8249-8267, CAplus
Other Names and Identifiers
InChI
InChI=1S/C28H33N7O2.CH4O3S/c1-7-27(36)30-22-16-23(26(37-6)17-25(22)34(4)15-14-33(2)3)32-28-29-13-12-21(31-28)20-18-35(5)24-11-9-8-10-19(20)24;1-5(2,3)4/h7-13,16-18H,1,14-15H2,2-6H3,(H,30,36)(H,29,31,32);1H3,(H,2,3,4)
InChIKey
InChIKey=FUKSNUHSJBTCFJ-UHFFFAOYSA-N
SMILES
CN1C=C(C=2C1=CC=CC2)C3=NC(NC4=C(OC)C=C(N(CCN(C)C)C)C(NC(C=C)=O)=C4)=NC=C3.S(C)(=O)(=O)O
Canonical SMILES
O=C(C=C)NC1=CC(NC=2N=CC=C(N2)C3=CN(C=4C=CC=CC34)C)=C(OC)C=C1N(C)CCN(C)C.O=S(=O)(O)C
Other Names for this Substance
- 2-Propenamide, N-[2-[[2-(dimethylamino)ethyl]methylamino]-4-methoxy-5-[[4-(1-methyl-1H-indol-3-yl)-2-pyrimidinyl]amino]phenyl]-, methanesulfonate (1:1)
- Osimertinib mesylate
- AZD 9291 mesylate
