Methyl 2-chloro-7-[1-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C23H33ClN4O4
Molecular Weight	464.986
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Methyl 2-chloro-7-[1-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Structure Search

SMILES

CC(C)(C)OC(=O)NCC1(CCCCC1)N2C(=CC3=C2N=C(Cl)N=C3)C(=O)OC(C)(C)C

InChI

InChIKey=NYVLGXHHPVBCPP-UHFFFAOYSA-N

InChI=1S/C23H33ClN4O4/c1-21(2,3)31-18(29)16-12-15-13-25-19(24)27-17(15)28(16)23(10-8-7-9-11-23)14-26-20(30)32-22(4,5)6/h12-13H,7-11,14H2,1-6H3,(H,26,30)

HIDE SMILES / InChI

Molecular Formula	C23H33ClN4O4
Molecular Weight	464.986
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 20:52:43 GMT 2025` Edited by `admin` on `Wed Apr 02 20:52:43 GMT 2025`
Record UNII	XCG4DTB7VC
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Methyl 2-chloro-7-[1-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]cyclohexyl]-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylate

Systematic Name

English

7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, 2-chloro-7-[1-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]cyclohexyl]-, methyl ester

Preferred Name

English

Code System Code Type Description

FDA UNII

XCG4DTB7VC

Created by admin on Wed Apr 02 20:52:43 GMT 2025 , Edited by admin on Wed Apr 02 20:52:43 GMT 2025

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CAS

2361992-25-6

Created by admin on Wed Apr 02 20:52:43 GMT 2025 , Edited by admin on Wed Apr 02 20:52:43 GMT 2025

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