U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C43H48F3N5O5
Molecular Weight 771.8669
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of SRX-251

SMILES

CN(CC1=CC=CC(=C1)C(F)(F)F)C(=O)[C@@H](CC(=O)N2CCC(CC2)N3CCCCC3)N4[C@H](\C=C\C5=CC=CC=C5)[C@H](N6[C@H](COC6=O)C7=CC=CC=C7)C4=O

InChI

InChIKey=GOQPVIZMGXUXOL-GRLAPFOSSA-N
InChI=1S/C43H48F3N5O5/c1-47(28-31-14-11-17-33(26-31)43(44,45)46)40(53)36(27-38(52)49-24-20-34(21-25-49)48-22-9-4-10-23-48)50-35(19-18-30-12-5-2-6-13-30)39(41(50)54)51-37(29-56-42(51)55)32-15-7-3-8-16-32/h2-3,5-8,11-19,26,34-37,39H,4,9-10,20-25,27-29H2,1H3/b19-18+/t35-,36-,37-,39+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
SRX-251
Common Name English
(2R)-N-METHYL-4-OXO-2-((3S,4R)-2-OXO-3-((4S)-2-OXO-4-PHENYL-OXAZOLIDIN-3-YL)-4-((E)-STYRYL)AZETIDIN-1-YL)-4-(4-(1-PIPERIDYL)-1-PIPERIDYL)-N-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)BUTANAMIDE
Systematic Name English
(1,4'-BIPIPERIDINE)-1'-BUTANAMIDE, N-METHYL-.GAMMA.-OXO-.ALPHA.-((3S,4R)-2-OXO-3-((4S)-2-OXO-4-PHENYL-3-OXAZOLIDINYL)-4-((1E)-2-PHENYLETHENYL)-1-AZETIDINYL)-N-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)-, (.ALPHA.R)-
Systematic Name English
SRX-251(E-ISOMER)
Code English
(.ALPHA.R)-N-METHYL-.GAMMA.-OXO-.ALPHA.-((3S,4R)-2-OXO-3-((4S)-2-OXO-4-PHENYL-3-OXAZOLIDINYL)-4-((1E)-2-PHENYLETHENYL)-1-AZETIDINYL)-N-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)(1,4'-BIPIPERIDINE)-1'-BUTANAMIDE
Systematic Name English
SRX 251
Code English
Code System Code Type Description
PUBCHEM
11686429
Created by admin on Sat Dec 16 11:29:49 GMT 2023 , Edited by admin on Sat Dec 16 11:29:49 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545146
Created by admin on Sat Dec 16 11:29:49 GMT 2023 , Edited by admin on Sat Dec 16 11:29:49 GMT 2023
PRIMARY
CAS
512784-94-0
Created by admin on Sat Dec 16 11:29:49 GMT 2023 , Edited by admin on Sat Dec 16 11:29:49 GMT 2023
PRIMARY
FDA UNII
G9Z22EU5FK
Created by admin on Sat Dec 16 11:29:49 GMT 2023 , Edited by admin on Sat Dec 16 11:29:49 GMT 2023
PRIMARY