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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H43N7O3
Molecular Weight 585.7396
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-779976

SMILES

C[C@H]([C@@H](NC(=O)N1CCC(CC1)N2C(=O)NC3=CC=CC=C23)C(=O)NC[C@@H]4CCC[C@H](CN)C4)C5=CNC6=C5C=CC=C6

InChI

InChIKey=DDVPVAOEMZRZQU-CXDLDTBJSA-N
InChI=1S/C33H43N7O3/c1-21(26-20-35-27-10-3-2-9-25(26)27)30(31(41)36-19-23-8-6-7-22(17-23)18-34)38-32(42)39-15-13-24(14-16-39)40-29-12-5-4-11-28(29)37-33(40)43/h2-5,9-12,20-24,30,35H,6-8,13-19,34H2,1H3,(H,36,41)(H,37,43)(H,38,42)/t21-,22-,23+,30+/m0/s1

HIDE SMILES / InChI

Molecular Formula C33H43N7O3
Molecular Weight 585.7396
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:08:18 GMT 2023
Edited
by admin
on Sat Dec 16 09:08:18 GMT 2023
Record UNII
U5B58A46QX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
L-779976
Common Name English
1H-INDOLE-3-PROPANAMIDE, N-(((1R,3S)-3-(AMINOMETHYL)CYCLOHEXYL)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
(.ALPHA.R,.BETA.S)-N-(((1R,3S)-3-(AMINOMETHYL)CYCLOHEXYL)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
Code System Code Type Description
CAS
214770-19-1
Created by admin on Sat Dec 16 09:08:18 GMT 2023 , Edited by admin on Sat Dec 16 09:08:18 GMT 2023
PRIMARY
FDA UNII
U5B58A46QX
Created by admin on Sat Dec 16 09:08:18 GMT 2023 , Edited by admin on Sat Dec 16 09:08:18 GMT 2023
PRIMARY
PUBCHEM
9873146
Created by admin on Sat Dec 16 09:08:18 GMT 2023 , Edited by admin on Sat Dec 16 09:08:18 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY