N6-CYCLOPROPYL-9-((1R,4S)-4-(((2,5-DIAMINO-6-CHLOROPYRIMIDIN-4-YL)OXY)METHYL)CYCLOPENT-2-EN-1-YL)-9H-PURINE-2,6-DIAMINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H21ClN10O
Molecular Weight	428.879
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N6-CYCLOPROPYL-9-((1R,4S)-4-(((2,5-DIAMINO-6-CHLOROPYRIMIDIN-4-YL)OXY)METHYL)CYCLOPENT-2-EN-1-YL)-9H-PURINE-2,6-DIAMINE

Structure Search

SMILES

NC1=NC2=C(N=CN2[C@@H]3C[C@H](COC4=NC(N)=NC(Cl)=C4N)C=C3)C(NC5CC5)=N1

InChI

InChIKey=GETKMSKGQYJOPI-SCZZXKLOSA-N

InChI=1S/C18H21ClN10O/c19-13-11(20)16(28-17(21)25-13)30-6-8-1-4-10(5-8)29-7-23-12-14(24-9-2-3-9)26-18(22)27-15(12)29/h1,4,7-10H,2-3,5-6,20H2,(H2,21,25,28)(H3,22,24,26,27)/t8-,10+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C18H21ClN10O
Molecular Weight	428.879
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 05:44:59 UTC 2023` Edited by `admin` on `Sat Dec 16 05:44:59 UTC 2023`
Record UNII	8YR0EYX97M
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N6-CYCLOPROPYL-9-((1R,4S)-4-(((2,5-DIAMINO-6-CHLOROPYRIMIDIN-4-YL)OXY)METHYL)CYCLOPENT-2-EN-1-YL)-9H-PURINE-2,6-DIAMINE

Systematic Name

English

N6-CYCLOPROPYL-9-((1R,4S)-4-((2,5-DIAMINO-6-CHLOROPYRIMIDIN-4-YLOXY)METHYL)CYCLOPENT-2-ENYL(-9H-PURINE-2,6-DIAMINE

Systematic Name

English

ABACAVIR RELATED COMPOUND D [USP IMPURITY]

Common Name

English

ABACAVIR RELATED COMPOUND D [USP-RS]

Common Name

English

6-(CYCLOPROPYLAMINO)-9-((1R,4S)-4-(((2,5-DIAMINO-6-CHLOROPYRIMIDIN-4-YL)OXY)METHYL)CYCLOPENT-2-ENYL)-9H-PURINE-2-AMINE

Systematic Name

English

ABACAVIR SULFATE IMPURITY B [WHO-IP]

Common Name

English

ABACAVIR SULFATE IMPURITY B [EP IMPURITY]

Common Name

English

9H-PURINE-2,6-DIAMINE, N6-CYCLOPROPYL-9-((1R,4S)-4-(((2,5-DIAMINO-6-CHLORO-4-PYRIMIDINYL)OXY)METHYL)-2-CYCLOPENTEN-1-YL)-

Systematic Name

English

O-PYRIMIDINE DERIVATIVE ABACAVIR [USP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

73425538

Created by admin on Sat Dec 16 05:45:00 UTC 2023 , Edited by admin on Sat Dec 16 05:45:00 UTC 2023

PRIMARY

FDA UNII

8YR0EYX97M

Created by admin on Sat Dec 16 05:45:00 UTC 2023 , Edited by admin on Sat Dec 16 05:45:00 UTC 2023

PRIMARY

CAS

1443421-69-9

Created by admin on Sat Dec 16 05:45:00 UTC 2023 , Edited by admin on Sat Dec 16 05:45:00 UTC 2023

PRIMARY

RS_ITEM_NUM

1000437

Created by admin on Sat Dec 16 05:45:00 UTC 2023 , Edited by admin on Sat Dec 16 05:45:00 UTC 2023

PRIMARY

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