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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16F3N7O
Molecular Weight 379.3397
Optical Activity ( - )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SRA-737, (S)-

SMILES

FC(F)(F)C1=CN=C(NC2=CN=C(C=N2)C#N)C=C1NC[C@@H]3CNCCO3

InChI

InChIKey=YBYYWUUUGCNAHQ-NSHDSACASA-N
InChI=1S/C16H16F3N7O/c17-16(18,19)12-8-25-14(26-15-9-22-10(4-20)5-24-15)3-13(12)23-7-11-6-21-1-2-27-11/h3,5,8-9,11,21H,1-2,6-7H2,(H2,23,24,25,26)/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16F3N7O
Molecular Weight 379.3397
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 19:06:16 GMT 2023
Edited
by admin
on Sat Dec 16 19:06:16 GMT 2023
Record UNII
LCR5PKK3H6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SRA-737, (S)-
Common Name English
CCT-245737, (S)-
Common Name English
2-PYRAZINECARBONITRILE, 5-((4-(((2S)-2-MORPHOLINYLMETHYL)AMINO)-5-(TRIFLUOROMETHYL)-2-PYRIDINYL)AMINO)-
Systematic Name English
5-((4-(((2S)-2-MORPHOLINYLMETHYL)AMINO)-5-(TRIFLUOROMETHYL)-2-PYRIDINYL)AMINO)-2-PYRAZINECARBONITRILE
Systematic Name English
CCT245737, (S)-
Common Name English
5-((4-((((2S)-MORPHOLIN-2-YL)METHYL)AMINO)-5-(TRIFLUOROMETHYL)PYRIDIN-2-YL)AMINO)PYRAZINE-2-CARBONITRILE
Systematic Name English
Code System Code Type Description
CAS
1489389-23-2
Created by admin on Sat Dec 16 19:06:16 GMT 2023 , Edited by admin on Sat Dec 16 19:06:16 GMT 2023
PRIMARY
PUBCHEM
72202596
Created by admin on Sat Dec 16 19:06:16 GMT 2023 , Edited by admin on Sat Dec 16 19:06:16 GMT 2023
PRIMARY
FDA UNII
LCR5PKK3H6
Created by admin on Sat Dec 16 19:06:16 GMT 2023 , Edited by admin on Sat Dec 16 19:06:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID501113332
Created by admin on Sat Dec 16 19:06:16 GMT 2023 , Edited by admin on Sat Dec 16 19:06:16 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER