1-METHYL ETHYL 1-CHLORO-5-(((5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL)AMINO)BENZOATE

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C16H18ClNO4S
Molecular Weight	355.836
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-METHYL ETHYL 1-CHLORO-5-(((5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL)AMINO)BENZOATE

Structure Search

SMILES

CC(C)OC(=O)C1=CC(NC(=O)C2=C(C)OCCS2)=CC=C1Cl

InChI

InChIKey=FMQGUMRNTBJHEA-UHFFFAOYSA-N

InChI=1S/C16H18ClNO4S/c1-9(2)22-16(20)12-8-11(4-5-13(12)17)18-15(19)14-10(3)21-6-7-23-14/h4-5,8-9H,6-7H2,1-3H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula	C16H18ClNO4S
Molecular Weight	355.836
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 `Wed Apr 02 09:53:30 GMT 2025` Edited by `admin` on `Wed Apr 02 09:53:30 GMT 2025`
Record UNII	IJ5WR6SKU5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-615985

Preferred Name

English

1-METHYL ETHYL 1-CHLORO-5-(((5,6DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL)AMINO)BENZOATE

Systematic Name

English

BENZOIC ACID, 2-CHLORO-5-(((5,6-DIHYDRO-2-METHYL-1,4-OXATHIIN-3-YL)CARBONYL)AMINO)-, 1-METHYLETHYL ESTER

Systematic Name

English

Code System Code Type Description

FDA UNII

IJ5WR6SKU5

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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NSC

615985

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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CAS

135812-04-3

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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PUBCHEM

1385

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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DRUG BANK

DB08682

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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EPA CompTox

DTXSID70159539

Created by admin on Wed Apr 02 09:53:30 GMT 2025 , Edited by admin on Wed Apr 02 09:53:30 GMT 2025

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