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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H22ClN3O3S
Molecular Weight 455.957
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of KRP-105, (R)-

SMILES

CC1=C(SC(=N1)C2=CC=C(Cl)C=C2)C(=O)N[C@@H]3CCCN(C3)C4=CC(=CC=C4)C(O)=O

InChI

InChIKey=UEIFAMIUBPSKHA-GOSISDBHSA-N
InChI=1S/C23H22ClN3O3S/c1-14-20(31-22(25-14)15-7-9-17(24)10-8-15)21(28)26-18-5-3-11-27(13-18)19-6-2-4-16(12-19)23(29)30/h2,4,6-10,12,18H,3,5,11,13H2,1H3,(H,26,28)(H,29,30)/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula C23H22ClN3O3S
Molecular Weight 455.957
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:08:35 GMT 2023
Edited
by admin
on Sat Dec 16 18:08:35 GMT 2023
Record UNII
Y7KKH4TH37
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
KRP-105, (R)-
Code English
BENZOIC ACID, 3-((3R)-3-(((2-(4-CHLOROPHENYL)-4-METHYL-5-THIAZOLYL)CARBONYL)AMINO)-1-PIPERIDINYL)-
Systematic Name English
3-((3R)-3-(((2-(4-CHLOROPHENYL)-4-METHYL-5-THIAZOLYL)CARBONYL)AMINO)-1-PIPERIDINYL)BENZOIC ACID
Systematic Name English
Code System Code Type Description
FDA UNII
Y7KKH4TH37
Created by admin on Sat Dec 16 18:08:35 GMT 2023 , Edited by admin on Sat Dec 16 18:08:35 GMT 2023
PRIMARY
PUBCHEM
11532616
Created by admin on Sat Dec 16 18:08:35 GMT 2023 , Edited by admin on Sat Dec 16 18:08:35 GMT 2023
PRIMARY
CAS
876145-68-5
Created by admin on Sat Dec 16 18:08:35 GMT 2023 , Edited by admin on Sat Dec 16 18:08:35 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER