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Product Overview

Product Code

TRC-M879780

CAS Number

2412166-56-2

Product Format

Neat

Molecular Formula

C30H25N7O3

Molecular Weight

531.58

Product Categories

TRC

Product Information

Analyte Name

4-[2-Methyl-4-oxo-9-[(2S)-1-(1-oxo-2-butyn-1-yl)-2-pyrrolidinyl]-4H-imidazo[5',1':3,4]pyrazino[1,2-a]pyrimidin-11-yl]-N-2-pyridinylbenzamide

CAS Number

2412166-56-2

Molecular Formula

C30H25N7O3

Molecular Weight

531.58

Accurate Mass

531.2

SMILES

O=C(NC1=NC=CC=C1)C2=CC=C(C=C2)C3=C4C(N5C=CN4C([C@@H]6CCCN6C(C#CC)=O)=N3)=NC(C)=CC5=O

InChI

InChI=1S/C30H25N7O3/c1-3-7-24(38)35-15-6-8-22(35)28-34-26(27-29-32-19(2)18-25(39)36(29)16-17-37(27)28)20-10-12-21(13-11-20)30(40)33-23-9-4-5-14-31-23/h4-5,9-14,16-18,22H,6,8,15H2,1-2H3,(H,31,33,40)/t22-/m0/s1

IUPAC

(S)-4-(9-(1-(but-2-ynoyl)pyrrolidin-2-yl)-2-methyl-4-oxo-4H-imidazo[5',1':3,4]pyrazino[1,2-a]pyrimidin-11-yl)-N-(pyridin-2-yl)benzamide

Country of Origin

CANADA

Product Format

Neat

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