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Details

Stereochemistry RACEMIC
Molecular Formula C28H32N4O2
Molecular Weight 456.5793
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KYS-05044

SMILES

COC(=O)CC1N(C(NCCCCCN)=NC2=C1C=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChIKey=IAVHQTHZEBUNLX-UHFFFAOYSA-N
InChI=1S/C28H32N4O2/c1-34-27(33)20-26-24-12-6-7-13-25(24)31-28(30-19-9-3-8-18-29)32(26)23-16-14-22(15-17-23)21-10-4-2-5-11-21/h2,4-7,10-17,26H,3,8-9,18-20,29H2,1H3,(H,30,31)

HIDE SMILES / InChI

Approval Year

Name Type Language
4-QUINAZOLINEACETIC ACID, 2-((5-AMINOPENTYL)AMINO)-3-(1,1'-BIPHENYL)-4-YL-3,4-DIHYDRO-, METHYL ESTER
Preferred Name English
KYS-05044
Code English
METHYL 2-((5-AMINOPENTYL)AMINO)-3-(1,1'-BIPHENYL)-4-YL-3,4-DIHYDRO-4-QUINAZOLINEACETATE
Systematic Name English
METHYL 2-(2-((5-AMINOPENTYL)AMINO)-3-((1,1'-BIPHENYL)-4-YL)-3,4-DIHYDROQUINAZOLIN-4-YL)ACETATE
Systematic Name English
KYS05044
Code English
Code System Code Type Description
CAS
839672-52-5
Created by admin on Mon Mar 31 22:49:36 GMT 2025 , Edited by admin on Mon Mar 31 22:49:36 GMT 2025
PRIMARY
FDA UNII
86DF8H8UWT
Created by admin on Mon Mar 31 22:49:36 GMT 2025 , Edited by admin on Mon Mar 31 22:49:36 GMT 2025
PRIMARY
CAS
1093791-59-3
Created by admin on Mon Mar 31 22:49:36 GMT 2025 , Edited by admin on Mon Mar 31 22:49:36 GMT 2025
SUPERSEDED
PUBCHEM
135462545
Created by admin on Mon Mar 31 22:49:36 GMT 2025 , Edited by admin on Mon Mar 31 22:49:36 GMT 2025
PRIMARY