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

Details

Stereochemistry	ACHIRAL
Molecular Formula	C31H32N6O4
Molecular Weight	552.6236
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

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

Structure Search

SMILES

CC(C)NC(=O)COC1=CC(=CC=C1)C2=NC(NC3=CC=C4N(N=CC4=C3)C(=O)OC(C)(C)C)=C5C=CC=CC5=N2

InChI

InChIKey=QEOBJJQEXYYWMR-UHFFFAOYSA-N

InChI=1S/C31H32N6O4/c1-19(2)33-27(38)18-40-23-10-8-9-20(16-23)28-35-25-12-7-6-11-24(25)29(36-28)34-22-13-14-26-21(15-22)17-32-37(26)30(39)41-31(3,4)5/h6-17,19H,18H2,1-5H3,(H,33,38)(H,34,35,36)

HIDE SMILES / InChI

Molecular Formula	C31H32N6O4
Molecular Weight	552.6236
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 19:55:12 GMT 2025` Edited by `admin` on `Wed Apr 02 19:55:12 GMT 2025`
Record UNII	B8R9A84RTP
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

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

Preferred Name

English

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

Systematic Name

English

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

Systematic Name

English

Code System Code Type Description

CAS

911417-95-3

Created by admin on Wed Apr 02 19:55:12 GMT 2025 , Edited by admin on Wed Apr 02 19:55:12 GMT 2025

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FDA UNII

B8R9A84RTP

Created by admin on Wed Apr 02 19:55:12 GMT 2025 , Edited by admin on Wed Apr 02 19:55:12 GMT 2025

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PUBCHEM

66826312

Created by admin on Wed Apr 02 19:55:12 GMT 2025 , Edited by admin on Wed Apr 02 19:55:12 GMT 2025

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