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

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H25N7O3
Molecular Weight	531.5646
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

CC#CC(=O)N1CCC[C@H]1C2=NC(=C3N2C=CN4C(C)=CC(=O)N=C34)C5=CC=C(C=C5)C(=O)NC6=NC=CC=C6

InChI

InChIKey=DBIHVGGBNOQUGX-QFIPXVFZSA-N

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

HIDE SMILES / InChI

Molecular Formula	C30H25N7O3
Molecular Weight	531.5646
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 10:10:02 GMT 2025` Edited by `admin` on `Wed Apr 02 10:10:02 GMT 2025`
Record UNII	3W68975U4W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Preferred Name

English

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

Systematic Name

English

Code System Code Type Description

PUBCHEM

164771821

Created by admin on Wed Apr 02 10:10:02 GMT 2025 , Edited by admin on Wed Apr 02 10:10:02 GMT 2025

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FDA UNII

3W68975U4W

Created by admin on Wed Apr 02 10:10:02 GMT 2025 , Edited by admin on Wed Apr 02 10:10:02 GMT 2025

PRIMARY