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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13NO2S
Molecular Weight 235.302
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYL 3-METHYL-4H-1,4-BENZOTHIAZINE-2-CARBOXYLATE

SMILES

CCOC(=O)C1=C(C)NC2=C(S1)C=CC=C2

InChI

InChIKey=NCZIRXVLKKERGP-UHFFFAOYSA-N
InChI=1S/C12H13NO2S/c1-3-15-12(14)11-8(2)13-9-6-4-5-7-10(9)16-11/h4-7,13H,3H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H13NO2S
Molecular Weight 235.302
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 Sat Dec 16 12:57:54 GMT 2023
Edited
by admin
on Sat Dec 16 12:57:54 GMT 2023
Record UNII
PQ637VI0V3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYL 3-METHYL-4H-1,4-BENZOTHIAZINE-2-CARBOXYLATE
Systematic Name English
ETHYL 3-METHYL-(4H)-1,4-BENZOTHIAZINE-2-CARBOXYLATE
Systematic Name English
2-(ETHOXYCARBONYL)-3-METHYL-4H-1,4-BENZOTHIAZINE
Systematic Name English
4H-1,4-BENZOTHIAZINE-2-CARBOXYLIC ACID, 3-METHYL-, ETHYL ESTER
Systematic Name English
NSC-622343
Code English
Code System Code Type Description
CAS
7625-01-6
Created by admin on Sat Dec 16 12:57:54 GMT 2023 , Edited by admin on Sat Dec 16 12:57:54 GMT 2023
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FDA UNII
PQ637VI0V3
Created by admin on Sat Dec 16 12:57:54 GMT 2023 , Edited by admin on Sat Dec 16 12:57:54 GMT 2023
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EPA CompTox
DTXSID20227116
Created by admin on Sat Dec 16 12:57:54 GMT 2023 , Edited by admin on Sat Dec 16 12:57:54 GMT 2023
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NSC
622343
Created by admin on Sat Dec 16 12:57:54 GMT 2023 , Edited by admin on Sat Dec 16 12:57:54 GMT 2023
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PUBCHEM
360308
Created by admin on Sat Dec 16 12:57:54 GMT 2023 , Edited by admin on Sat Dec 16 12:57:54 GMT 2023
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