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Details

Stereochemistry ACHIRAL
Molecular Formula C15H12N2OS
Molecular Weight 268.334
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-HYDROXY-4-(METHYLTHIO)-5,6-DIHYDROBENZO(H)QUINOLINE-3-CARBONITRILE

SMILES

CSC1=C(C#N)C(O)=NC2=C1CCC3=CC=CC=C23

InChI

InChIKey=GUUCCZXZHBJWHQ-UHFFFAOYSA-N
InChI=1S/C15H12N2OS/c1-19-14-11-7-6-9-4-2-3-5-10(9)13(11)17-15(18)12(14)8-16/h2-5H,6-7H2,1H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C15H12N2OS
Molecular Weight 268.334
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 Tue Apr 01 19:51:15 GMT 2025
Edited
by admin
on Tue Apr 01 19:51:15 GMT 2025
Record UNII
AR9I77V8T2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-HYDROXY-4-(METHYLTHIO)-5,6-DIHYDROBENZO(H)QUINOLINE-3-CARBONITRILE
Systematic Name English
NSC-377369
Preferred Name English
1,2,5,6-TETRAHYDRO-4-(METHYLTHIO)-2-OXOBENZO(H)QUINOLINE-3-CARBONITRILE
Systematic Name English
BENZO(H)QUINOLINE-3-CARBONITRILE, 5,6-DIHYDRO-2-HYDROXY-4-(METHYLTHIO)-
Systematic Name English
BENZO(H)QUINOLINE-3-CARBONITRILE, 1,2,5,6-TETRAHYDRO-4-(METHYLTHIO)-2-OXO-
Systematic Name English
Code System Code Type Description
CAS
28559-55-9
Created by admin on Tue Apr 01 19:51:15 GMT 2025 , Edited by admin on Tue Apr 01 19:51:15 GMT 2025
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NSC
377369
Created by admin on Tue Apr 01 19:51:15 GMT 2025 , Edited by admin on Tue Apr 01 19:51:15 GMT 2025
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FDA UNII
AR9I77V8T2
Created by admin on Tue Apr 01 19:51:15 GMT 2025 , Edited by admin on Tue Apr 01 19:51:15 GMT 2025
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PUBCHEM
342101
Created by admin on Tue Apr 01 19:51:15 GMT 2025 , Edited by admin on Tue Apr 01 19:51:15 GMT 2025
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EPA CompTox
DTXSID80182772
Created by admin on Tue Apr 01 19:51:15 GMT 2025 , Edited by admin on Tue Apr 01 19:51:15 GMT 2025
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