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Details

Stereochemistry ABSOLUTE
Molecular Formula C32H36N8O3
Molecular Weight 580.68
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-054852

SMILES

C[C@H]([C@@H](NC(=O)N1CCC(CC1)N2C(=O)NC3=CC=CC=C23)C(=O)NCC4=NC=CC(CN)=C4)C5=CNC6=C5C=CC=C6

InChI

InChIKey=VKNLQDPIGKMXPG-AFJIDDCJSA-N
InChI=1S/C32H36N8O3/c1-20(25-19-35-26-7-3-2-6-24(25)26)29(30(41)36-18-22-16-21(17-33)10-13-34-22)38-31(42)39-14-11-23(12-15-39)40-28-9-5-4-8-27(28)37-32(40)43/h2-10,13,16,19-20,23,29,35H,11-12,14-15,17-18,33H2,1H3,(H,36,41)(H,37,43)(H,38,42)/t20-,29+/m0/s1

HIDE SMILES / InChI

Molecular Formula C32H36N8O3
Molecular Weight 580.68
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:46:14 GMT 2023
Edited
by admin
on Sat Dec 16 09:46:14 GMT 2023
Record UNII
FW7R3S5E6T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-054852
Code English
(.ALPHA.R,.BETA.S)-N-((4-(AMINOMETHYL)-2-PYRIDINYL)METHYL)-.ALPHA.-(((4-(2,3-DIHYDRO-2-OXO-1H-BENZIMIDAZOL-1-YL)-1-PIPERIDINYL)CARBONYL)AMINO)-.BETA.-METHYL-1H-INDOLE-3-PROPANAMIDE
Systematic Name English
L054852
Code English
1H-INDOLE-3-PROPANAMIDE, N-((4-(AMINOMETHYL)-2-PYRIDINYL)METHYL)-.ALPHA.-(((4-(2,3-DIHYDRO-2-OXO-1H-BENZIMIDAZOL-1-YL)-1-PIPERIDINYL)CARBONYL)AMINO)-.BETA.-METHYL-, (.ALPHA.R,.BETA.S)-
Systematic Name English
Code System Code Type Description
CAS
214471-63-3
Created by admin on Sat Dec 16 09:46:14 GMT 2023 , Edited by admin on Sat Dec 16 09:46:14 GMT 2023
PRIMARY
FDA UNII
FW7R3S5E6T
Created by admin on Sat Dec 16 09:46:14 GMT 2023 , Edited by admin on Sat Dec 16 09:46:14 GMT 2023
PRIMARY
PUBCHEM
54396761
Created by admin on Sat Dec 16 09:46:14 GMT 2023 , Edited by admin on Sat Dec 16 09:46:14 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY