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Details

Stereochemistry EPIMERIC
Molecular Formula C37H37ClN5O5P
Molecular Weight 698.147
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-[1-[(2R,6S)-6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-trityl-morpholin-2-yl]-2-oxo-pyrimidin-4-yl]benzamide

SMILES

CN(C)P(Cl)(=O)OC[C@@H]1CN(C[C@@H](O1)N2C=CC(NC(=O)C3=CC=CC=C3)=NC2=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChIKey=RCQVHNTXMQCQLT-AUIRFOQBSA-N
InChI=1S/C37H37ClN5O5P/c1-41(2)49(38,46)47-27-32-25-42(26-34(48-32)43-24-23-33(40-36(43)45)39-35(44)28-15-7-3-8-16-28)37(29-17-9-4-10-18-29,30-19-11-5-12-20-30)31-21-13-6-14-22-31/h3-24,32,34H,25-27H2,1-2H3,(H,39,40,44,45)/t32-,34+,49?/m0/s1

HIDE SMILES / InChI

Molecular Formula C37H37ClN5O5P
Molecular Weight 698.147
Charge 0
Count
Stereochemistry EPIMERIC
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 19:49:03 GMT 2023
Edited
by admin
on Sat Dec 16 19:49:03 GMT 2023
Record UNII
WGS8BF4AGW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-[1-[(2R,6S)-6-[[chloro(dimethylamino)phosphoryl]oxymethyl]-4-trityl-morpholin-2-yl]-2-oxo-pyrimidin-4-yl]benzamide
Systematic Name English
N,N-DimethylphosphoramidochloridicAcid[(2S,6R)-6-[4-(Benzoylamino)-2-oxo-1(2H)-pyrimidinyl]-4-(triphenylmethyl)-2-morpholinyl]methylester
Systematic Name English
[(2S,6R)-6-[4-(Benzoylamino)-2-oxo-1(2H)-pyrimidinyl]-4-(triphenylmethyl)-2-morpholinyl]methyl N,N-dimethylphosphoramidochloridate
Systematic Name English
Phosphoramidochloridic acid, N,N-dimethyl-, [(2S,6R)-6-[4-(benzoylamino)-2-oxo-1(2H)-pyrimidinyl]-4-(triphenylmethyl)-2-morpholinyl]methyl ester
Systematic Name English
Code System Code Type Description
CAS
956139-21-2
Created by admin on Sat Dec 16 19:49:03 GMT 2023 , Edited by admin on Sat Dec 16 19:49:03 GMT 2023
PRIMARY
PUBCHEM
16662132
Created by admin on Sat Dec 16 19:49:03 GMT 2023 , Edited by admin on Sat Dec 16 19:49:03 GMT 2023
PRIMARY
FDA UNII
WGS8BF4AGW
Created by admin on Sat Dec 16 19:49:03 GMT 2023 , Edited by admin on Sat Dec 16 19:49:03 GMT 2023
PRIMARY