2-[(2,6-Difluorophenyl)methyl-methoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H26F2N4O6S
Molecular Weight	548.559
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-[(2,6-Difluorophenyl)methyl-methoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid

Structure Search

SMILES

CONC(=O)NC1=CC=C(C=C1)C2=C(CN(C)C)C(C(O)=O)=C(S2)N(CC3=C(F)C=CC=C3F)C(=O)OC

InChI

InChIKey=LUVAVYFYTMBSOI-UHFFFAOYSA-N

InChI=1S/C25H26F2N4O6S/c1-30(2)12-17-20(23(32)33)22(31(25(35)36-3)13-16-18(26)6-5-7-19(16)27)38-21(17)14-8-10-15(11-9-14)28-24(34)29-37-4/h5-11H,12-13H2,1-4H3,(H,32,33)(H2,28,29,34)

HIDE SMILES / InChI

Molecular Formula	C25H26F2N4O6S
Molecular Weight	548.559
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 19:09:28 GMT 2025` Edited by `admin` on `Wed Apr 02 19:09:28 GMT 2025`
Record UNII	J2AB4J55KN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-[(2,6-Difluorophenyl)methyl-methoxycarbonylamino]-4-[(dimethylamino)methyl]-5-[4-(methoxycarbamoylamino)phenyl]thiophene-3-carboxylic acid

Preferred Name

English

Code System Code Type Description

PUBCHEM

169230147

Created by admin on Wed Apr 02 19:09:28 GMT 2025 , Edited by admin on Wed Apr 02 19:09:28 GMT 2025

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FDA UNII

J2AB4J55KN

Created by admin on Wed Apr 02 19:09:28 GMT 2025 , Edited by admin on Wed Apr 02 19:09:28 GMT 2025

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CAS

2902790-16-1

Created by admin on Wed Apr 02 19:09:28 GMT 2025 , Edited by admin on Wed Apr 02 19:09:28 GMT 2025

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