N-METHYL-N-((3R,4R)-4-METHYL-1-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)PIPERIDIN-3-YL)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H22N8
Molecular Weight	362.4316
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-METHYL-N-((3R,4R)-4-METHYL-1-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)PIPERIDIN-3-YL)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE

Structure Search

SMILES

C[C@@H]1CCN(C[C@@H]1N(C)C2=C3C=CNC3=NC=N2)C4=C5C=CNC5=NC=N4

InChI

InChIKey=SMRQHAISNZVPQG-DOMZBBRYSA-N

InChI=1S/C19H22N8/c1-12-5-8-27(19-14-4-7-21-17(14)23-11-25-19)9-15(12)26(2)18-13-3-6-20-16(13)22-10-24-18/h3-4,6-7,10-12,15H,5,8-9H2,1-2H3,(H,20,22,24)(H,21,23,25)/t12-,15+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H22N8
Molecular Weight	362.4316
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:11:53 UTC 2023` Edited by `admin` on `Sat Dec 16 19:11:53 UTC 2023`
Record UNII	7GG8V8NPD3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N-METHYL-N-((3R,4R)-4-METHYL-1-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)PIPERIDIN-3-YL)-7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE

Systematic Name

English

7H-PYRROLO(2,3-D)PYRIMIDIN-4-AMINE, N-METHYL-N-((3R,4R)-4-METHYL-1-(7H-PYRROLO(2,3-D)PYRIMIDIN-4-YL)-3-PIPERIDINYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

7GG8V8NPD3

Created by admin on Sat Dec 16 19:11:53 UTC 2023 , Edited by admin on Sat Dec 16 19:11:53 UTC 2023

PRIMARY

PUBCHEM

151871061

Created by admin on Sat Dec 16 19:11:53 UTC 2023 , Edited by admin on Sat Dec 16 19:11:53 UTC 2023

PRIMARY

CAS

2504210-38-0

Created by admin on Sat Dec 16 19:11:53 UTC 2023 , Edited by admin on Sat Dec 16 19:11:53 UTC 2023

PRIMARY

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