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Details

Stereochemistry ABSOLUTE
Molecular Formula C26H23F3N4O6
Molecular Weight 544.4792
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[4-[[(3,4-Dihydro-2-methyl-4-oxo-6-quinazolinyl)methyl]-2-propyn-1-ylamino]-2-(trifluoromethyl)benzoyl]-L-glutamic acid

SMILES

CC1=NC(=O)C2=C(N1)C=CC(CN(CC#C)C3=CC=C(C(=O)N[C@@H](CCC(O)=O)C(O)=O)C(=C3)C(F)(F)F)=C2

InChI

InChIKey=QVJDQRGWHLSUHB-NRFANRHFSA-N
InChI=1S/C26H23F3N4O6/c1-3-10-33(13-15-4-7-20-18(11-15)24(37)31-14(2)30-20)16-5-6-17(19(12-16)26(27,28)29)23(36)32-21(25(38)39)8-9-22(34)35/h1,4-7,11-12,21H,8-10,13H2,2H3,(H,32,36)(H,34,35)(H,38,39)(H,30,31,37)/t21-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
N-[4-[[(3,4-Dihydro-2-methyl-4-oxo-6-quinazolinyl)methyl]-2-propyn-1-ylamino]-2-(trifluoromethyl)benzoyl]-L-glutamic acid
Systematic Name English
L-Glutamic acid, N-[4-[[(1,4-dihydro-2-methyl-4-oxo-6-quinazolinyl)methyl]-2-propynylamino]-2-(trifluoromethyl)benzoyl]-
Preferred Name English
L-Glutamic acid, N-[4-[[(3,4-dihydro-2-methyl-4-oxo-6-quinazolinyl)methyl]-2-propyn-1-ylamino]-2-(trifluoromethyl)benzoyl]-
Systematic Name English
Code System Code Type Description
FDA UNII
M48L3LJW4Q
Created by admin on Mon Mar 31 22:23:20 GMT 2025 , Edited by admin on Mon Mar 31 22:23:20 GMT 2025
PRIMARY
CAS
112888-26-3
Created by admin on Mon Mar 31 22:23:20 GMT 2025 , Edited by admin on Mon Mar 31 22:23:20 GMT 2025
PRIMARY
EPA CompTox
DTXSID20920938
Created by admin on Mon Mar 31 22:23:20 GMT 2025 , Edited by admin on Mon Mar 31 22:23:20 GMT 2025
PRIMARY
PUBCHEM
135625341
Created by admin on Mon Mar 31 22:23:20 GMT 2025 , Edited by admin on Mon Mar 31 22:23:20 GMT 2025
PRIMARY