Ethyl 3-(3-(2-((4-cyanophenyl)amino)acetamido)-4-(methylamino)-N-(pyridin-2-yl)benzamido)propanoate

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H28N6O4
Molecular Weight	500.549
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Ethyl 3-(3-(2-((4-cyanophenyl)amino)acetamido)-4-(methylamino)-N-(pyridin-2-yl)benzamido)propanoate

Structure Search

SMILES

CCOC(=O)CCN(C(=O)C1=CC=C(NC)C(NC(=O)CNC2=CC=C(C=C2)C#N)=C1)C3=NC=CC=C3

InChI

InChIKey=YSRISVJGBBRNHY-UHFFFAOYSA-N

InChI=1S/C27H28N6O4/c1-3-37-26(35)13-15-33(24-6-4-5-14-30-24)27(36)20-9-12-22(29-2)23(16-20)32-25(34)18-31-21-10-7-19(17-28)8-11-21/h4-12,14,16,29,31H,3,13,15,18H2,1-2H3,(H,32,34)

HIDE SMILES / InChI

Molecular Formula	C27H28N6O4
Molecular Weight	500.549
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 17:17:06 GMT 2025` Edited by `admin` on `Wed Apr 02 17:17:06 GMT 2025`
Record UNII	5DTT3ZVD3H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

?-Alanine, N-(4-cyanophenyl)glycyl-3-amino-4-(methylamino)benzoyl-N-2-pyridinyl-, ethyl ester

Preferred Name

English

Ethyl 3-(3-(2-((4-cyanophenyl)amino)acetamido)-4-(methylamino)-N-(pyridin-2-yl)benzamido)propanoate

Systematic Name

English

N-(4-Cyanophenyl)glycyl-3-amino-4-(methylamino)benzoyl-N-2-pyridinyl-?-alanine ethyl ester

Systematic Name

English

Code System Code Type Description

PUBCHEM

29944107

Created by admin on Wed Apr 02 17:17:06 GMT 2025 , Edited by admin on Wed Apr 02 17:17:06 GMT 2025

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FDA UNII

5DTT3ZVD3H

Created by admin on Wed Apr 02 17:17:06 GMT 2025 , Edited by admin on Wed Apr 02 17:17:06 GMT 2025

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CAS

948551-71-1

Created by admin on Wed Apr 02 17:17:06 GMT 2025 , Edited by admin on Wed Apr 02 17:17:06 GMT 2025

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