ETHYL 2-AMINO-5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA(B)THIOPHENE-3-CARBOXYLATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H17NO2S
Molecular Weight	239.334
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL 2-AMINO-5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA(B)THIOPHENE-3-CARBOXYLATE

Structure Search

SMILES

CCOC(=O)C1=C(N)SC2=C1CCCCC2

InChI

InChIKey=XTUHIGALMIGZST-UHFFFAOYSA-N

InChI=1S/C12H17NO2S/c1-2-15-12(14)10-8-6-4-3-5-7-9(8)16-11(10)13/h2-7,13H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H17NO2S
Molecular Weight	239.334
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 19:44:18 GMT 2025` Edited by `admin` on `Tue Apr 01 19:44:18 GMT 2025`
Record UNII	Y0J6EW5JJ4
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL 2-AMINO-5,6,7,8-TETRAHYDRO-4H-CYCLOHEPTA(B)THIOPHENE-3-CARBOXYLATE

Systematic Name

English

NSC-158551

Preferred Name

English

4H-CYCLOHEPTA(B)THIOPHENE-3-CARBOXYLIC ACID, 2-AMINO-5,6,7,8-TETRAHYDRO-, ETHYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

40106-13-6

Created by admin on Tue Apr 01 19:44:18 GMT 2025 , Edited by admin on Tue Apr 01 19:44:18 GMT 2025

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FDA UNII

Y0J6EW5JJ4

Created by admin on Tue Apr 01 19:44:18 GMT 2025 , Edited by admin on Tue Apr 01 19:44:18 GMT 2025

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PUBCHEM

292644

Created by admin on Tue Apr 01 19:44:18 GMT 2025 , Edited by admin on Tue Apr 01 19:44:18 GMT 2025

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NSC

158551

Created by admin on Tue Apr 01 19:44:18 GMT 2025 , Edited by admin on Tue Apr 01 19:44:18 GMT 2025

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EPA CompTox

DTXSID60193149

Created by admin on Tue Apr 01 19:44:18 GMT 2025 , Edited by admin on Tue Apr 01 19:44:18 GMT 2025

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