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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H21NO3S2
Molecular Weight 375.505
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AZD-4407

SMILES

C[C@H]1C[C@](O)(CCO1)C2=CSC(SC3=CC4=C(C=C3)N(C)C(=O)C4)=C2

InChI

InChIKey=MQLADKMVHOOVET-HXPMCKFVSA-N
InChI=1S/C19H21NO3S2/c1-12-10-19(22,5-6-23-12)14-9-18(24-11-14)25-15-3-4-16-13(7-15)8-17(21)20(16)2/h3-4,7,9,11-12,22H,5-6,8,10H2,1-2H3/t12-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C19H21NO3S2
Molecular Weight 375.505
Charge 0
Count
Stereochemistry ABSOLUTE
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 10:37:39 GMT 2023
Edited
by admin
on Sat Dec 16 10:37:39 GMT 2023
Record UNII
2NV5BTN3UD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZD-4407
Code English
2H-INDOL-2-ONE, 1,3-DIHYDRO-1-METHYL-5-((4-(TETRAHYDRO-4-HYDROXY-2-METHYL-2H-PYRAN-4-YL)-2-THIENYL)THIO)-, (2S-TRANS)-
Common Name English
ZD4407
Code English
ZD-4407
Code English
AZD4407
Code English
2H-INDOL-2-ONE, 1,3-DIHYDRO-1-METHYL-5-((4-((2S,4R)-TETRAHYDRO-4-HYDROXY-2-METHYL-2H-PYRAN-4-YL)-2-THIENYL)THIO)-
Systematic Name English
5-(4-((2S,4R)-4-HYDROXY-2-METHYLOXAN-4-YL)THIOPHEN-2-YL)SULFANYL-1-METHYL-3H-INDOL-2-ONE
Systematic Name English
1,3-DIHYDRO-1-METHYL-5-((4-((2S,4R)-TETRAHYDRO-4-HYDROXY-2-METHYL-2H-PYRAN-4-YL)-2-THIENYL)THIO)-2H-INDOL-2-ONE
Systematic Name English
Code System Code Type Description
CAS
166882-70-8
Created by admin on Sat Dec 16 10:37:39 GMT 2023 , Edited by admin on Sat Dec 16 10:37:39 GMT 2023
PRIMARY
PUBCHEM
9929535
Created by admin on Sat Dec 16 10:37:39 GMT 2023 , Edited by admin on Sat Dec 16 10:37:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID50432998
Created by admin on Sat Dec 16 10:37:39 GMT 2023 , Edited by admin on Sat Dec 16 10:37:39 GMT 2023
PRIMARY
MANUFACTURER PRODUCT INFORMATION
AZD-4407
Created by admin on Sat Dec 16 10:37:39 GMT 2023 , Edited by admin on Sat Dec 16 10:37:39 GMT 2023
PRIMARY http://atvb.ahajournals.org/content/early/2014/10/16/ATVBAHA.114.304016.full.pdf
FDA UNII
2NV5BTN3UD
Created by admin on Sat Dec 16 10:37:39 GMT 2023 , Edited by admin on Sat Dec 16 10:37:39 GMT 2023
PRIMARY
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