tert-Butyl 5-[[2-(3-acetoxyphenyl)quinazolin-4-yl]amino]-1H-indazole-1-carboxylate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C28H25N5O4
Molecular Weight	495.5292
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of tert-Butyl 5-[[2-(3-acetoxyphenyl)quinazolin-4-yl]amino]-1H-indazole-1-carboxylate

Structure Search

SMILES

CC(=O)OC1=CC(=CC=C1)C2=NC3=C(C=CC=C3)C(NC4=CC5=C(C=C4)N(N=C5)C(=O)OC(C)(C)C)=N2

InChI

InChIKey=GFYRAHRKWKCUHG-UHFFFAOYSA-N

InChI=1S/C28H25N5O4/c1-17(34)36-21-9-7-8-18(15-21)25-31-23-11-6-5-10-22(23)26(32-25)30-20-12-13-24-19(14-20)16-29-33(24)27(35)37-28(2,3)4/h5-16H,1-4H3,(H,30,31,32)

HIDE SMILES / InChI

Molecular Formula	C28H25N5O4
Molecular Weight	495.5292
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 20:23:58 GMT 2025` Edited by `admin` on `Wed Apr 02 20:23:58 GMT 2025`
Record UNII	3G8GC3RXU4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

tert-Butyl 5-[[2-(3-acetoxyphenyl)quinazolin-4-yl]amino]-1H-indazole-1-carboxylate

Systematic Name

English

1,1-Dimethylethyl 5-[[2-[3-(acetyloxy)phenyl]-4-quinazolinyl]amino]-1H-indazole-1-carboxylate

Preferred Name

English

1H-Indazole-1-carboxylic acid, 5-[[2-[3-(acetyloxy)phenyl]-4-quinazolinyl]amino]-, 1,1-dimethylethyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

66826370

Created by admin on Wed Apr 02 20:23:58 GMT 2025 , Edited by admin on Wed Apr 02 20:23:58 GMT 2025

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CAS

911417-25-9

Created by admin on Wed Apr 02 20:23:58 GMT 2025 , Edited by admin on Wed Apr 02 20:23:58 GMT 2025

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FDA UNII

3G8GC3RXU4

Created by admin on Wed Apr 02 20:23:58 GMT 2025 , Edited by admin on Wed Apr 02 20:23:58 GMT 2025

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