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Details

Stereochemistry ACHIRAL
Molecular Formula C24H28N4O8S
Molecular Weight 532.566
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SAD-448

SMILES

CCOC(=O)C1=C(C)C=C2N=C(COC(=O)NCCO)N(C(=O)C2=C1C)C3=C(C=CC=C3)S(=O)(=O)NC

InChI

InChIKey=PMBUDILHPXTDNY-UHFFFAOYSA-N
InChI=1S/C24H28N4O8S/c1-5-35-23(31)20-14(2)12-16-21(15(20)3)22(30)28(19(27-16)13-36-24(32)26-10-11-29)17-8-6-7-9-18(17)37(33,34)25-4/h6-9,12,25,29H,5,10-11,13H2,1-4H3,(H,26,32)

HIDE SMILES / InChI

Molecular Formula C24H28N4O8S
Molecular Weight 532.566
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 16:32:50 GMT 2023
Edited
by admin
on Fri Dec 15 16:32:50 GMT 2023
Record UNII
951G84HQ4I
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SAD-448
Code English
6-QUINAZOLINECARBOXYLIC ACID, 3,4-DIHYDRO-2-(((((2-HYDROXYETHYL)AMINO)CARBONYL)OXY)METHYL)-5,7-DIMETHYL-3-(2-((METHYLAMINO)SULFONYL)PHENYL)-4-OXO-, ETHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
581106-09-4
Created by admin on Fri Dec 15 16:32:50 GMT 2023 , Edited by admin on Fri Dec 15 16:32:50 GMT 2023
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FDA UNII
951G84HQ4I
Created by admin on Fri Dec 15 16:32:50 GMT 2023 , Edited by admin on Fri Dec 15 16:32:50 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545387
Created by admin on Fri Dec 15 16:32:50 GMT 2023 , Edited by admin on Fri Dec 15 16:32:50 GMT 2023
PRIMARY
PUBCHEM
9828471
Created by admin on Fri Dec 15 16:32:50 GMT 2023 , Edited by admin on Fri Dec 15 16:32:50 GMT 2023
PRIMARY