ATI-22-107

Details

Stereochemistry	RACEMIC
Molecular Formula	C31H32Cl2N4O8
Molecular Weight	659.514
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)C1=C(C)NC(COCCNC(=O)COC2=CC=C(C=C2Cl)C3=NNC(=O)CC3)=C(C1C4=CC=CC=C4Cl)C(=O)OC

InChI

InChIKey=IEWHOLAJSCSUMW-UHFFFAOYSA-N

InChI=1S/C31H32Cl2N4O8/c1-17-27(30(40)42-2)28(19-6-4-5-7-20(19)32)29(31(41)43-3)23(35-17)15-44-13-12-34-26(39)16-45-24-10-8-18(14-21(24)33)22-9-11-25(38)37-36-22/h4-8,10,14,28,35H,9,11-13,15-16H2,1-3H3,(H,34,39)(H,37,38)

HIDE SMILES / InChI

Molecular Formula	C31H32Cl2N4O8
Molecular Weight	659.514
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:33:57 GMT 2025` Edited by `admin` on `Mon Mar 31 23:33:57 GMT 2025`
Record UNII	ACV050QCE2
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

ATI-22107

Preferred Name

English

ATI-22-107

Common Name

English

3,5-PYRIDINEDICARBOXYLIC ACID, 4-(2-CHLOROPHENYL)-2-((2-(((2-CHLORO-4-(1,4,5,6-TETRAHYDRO-6-OXO-3-PYRIDAZINYL)PHENOXY)ACETYL)AMINO)ETHOXY)METHYL)-1,4-DIHYDRO-6-METHYL-, DIMETHYL ESTER

Systematic Name

English

3,5-PYRIDINEDICARBOXYLIC ACID, 4-(2-CHLOROPHENYL)-2-((2-((2-(2-CHLORO-4-(1,4,5,6-TETRAHYDRO-6-OXO-3-PYRIDAZINYL)PHENOXY)ACETYL)AMINO)ETHOXY)METHYL)-1,4-DIHYDRO-6-METHYL-, 3,5-DIMETHYL ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

ACV050QCE2

Created by admin on Mon Mar 31 23:33:57 GMT 2025 , Edited by admin on Mon Mar 31 23:33:57 GMT 2025

PRIMARY

PUBCHEM

10009561

Created by admin on Mon Mar 31 23:33:57 GMT 2025 , Edited by admin on Mon Mar 31 23:33:57 GMT 2025

PRIMARY

CAS

681816-57-9

Created by admin on Mon Mar 31 23:33:57 GMT 2025 , Edited by admin on Mon Mar 31 23:33:57 GMT 2025

PRIMARY

Related Record Type Details


					ACV050QCE2

ATI-22-107

ACTIVE MOIETY