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Details

Stereochemistry ACHIRAL
Molecular Formula C17H12N2O2S
Molecular Weight 308.354
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PHENYL-1,4-DIHYDROTHIOCHROMENO(4,3-C)PYRAZOLE-3-CARBOXYLIC ACID

SMILES

OC(=O)C1=NN(C2=C1CSC3=C2C=CC=C3)C4=CC=CC=C4

InChI

InChIKey=KGCPHZNGYDYXTL-UHFFFAOYSA-N
InChI=1S/C17H12N2O2S/c20-17(21)15-13-10-22-14-9-5-4-8-12(14)16(13)19(18-15)11-6-2-1-3-7-11/h1-9H,10H2,(H,20,21)

HIDE SMILES / InChI

Molecular Formula C17H12N2O2S
Molecular Weight 308.354
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 19:48:19 GMT 2025
Edited
by admin
on Tue Apr 01 19:48:19 GMT 2025
Record UNII
1P3L7TD8A9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-320964
Preferred Name English
1-PHENYL-1,4-DIHYDROTHIOCHROMENO(4,3-C)PYRAZOLE-3-CARBOXYLIC ACID
Systematic Name English
(1)BENZOTHIOPYRANO(4,3-C)PYRAZOLE-3-CARBOXYLIC ACID, 1,4-DIHYDRO-1-PHENYL-
Systematic Name English
1,4-DIHYDRO-1-PHENYL(1)BENZOTHIOPYRANO(4,3-C)PYRAZOLE-3-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50219145
Created by admin on Tue Apr 01 19:48:19 GMT 2025 , Edited by admin on Tue Apr 01 19:48:19 GMT 2025
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CAS
69099-25-8
Created by admin on Tue Apr 01 19:48:19 GMT 2025 , Edited by admin on Tue Apr 01 19:48:19 GMT 2025
PRIMARY
FDA UNII
1P3L7TD8A9
Created by admin on Tue Apr 01 19:48:19 GMT 2025 , Edited by admin on Tue Apr 01 19:48:19 GMT 2025
PRIMARY
NSC
320964
Created by admin on Tue Apr 01 19:48:19 GMT 2025 , Edited by admin on Tue Apr 01 19:48:19 GMT 2025
PRIMARY
PUBCHEM
330983
Created by admin on Tue Apr 01 19:48:19 GMT 2025 , Edited by admin on Tue Apr 01 19:48:19 GMT 2025
PRIMARY