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Details

Stereochemistry ABSOLUTE
Molecular Formula C24H28N4O7S
Molecular Weight 516.567
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NS-1209, (S)-

SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)C2=C3CCN(C)CC3=C4NC(=O)\C(=N/O[C@@H](CCO)C(O)=O)C4=C2

InChI

InChIKey=CFJRSKULEDUDKL-FQEVSTJZSA-N
InChI=1S/C24H28N4O7S/c1-27(2)36(33,34)15-6-4-14(5-7-15)17-12-18-21(19-13-28(3)10-8-16(17)19)25-23(30)22(18)26-35-20(9-11-29)24(31)32/h4-7,12,20,29H,8-11,13H2,1-3H3,(H,31,32)(H,25,26,30)/t20-/m0/s1

HIDE SMILES / InChI

Molecular Formula C24H28N4O7S
Molecular Weight 516.567
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 03:15:14 GMT 2023
Edited
by admin
on Sat Dec 16 03:15:14 GMT 2023
Record UNII
6901307Z5U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NS-1209, (S)-
Common Name English
SPD-502, (S)-
Code English
(S)-NS-1209
Code English
NS-1220
Code English
BUTANOIC ACID, 2-(((Z)-(5-(4-((DIMETHYLAMINO)SULFONYL)PHENYL)-1,2,6,7,8,9-HEXAHYDRO-8-METHYL-2-OXO-3H-PYRROLO(3,2-H)ISOQUINOLIN-3-YLIDENE)AMINO)OXY)-4-HYDROXY-, (2S)-
Systematic Name English
Code System Code Type Description
FDA UNII
6901307Z5U
Created by admin on Sat Dec 16 03:15:14 GMT 2023 , Edited by admin on Sat Dec 16 03:15:14 GMT 2023
PRIMARY
CAS
233603-82-2
Created by admin on Sat Dec 16 03:15:14 GMT 2023 , Edited by admin on Sat Dec 16 03:15:14 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
PUBCHEM
135539121
Created by admin on Sat Dec 16 03:15:14 GMT 2023 , Edited by admin on Sat Dec 16 03:15:14 GMT 2023
PRIMARY
CAS
666706-39-4
Created by admin on Sat Dec 16 03:15:14 GMT 2023 , Edited by admin on Sat Dec 16 03:15:14 GMT 2023
PRIMARY