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Details

Stereochemistry ACHIRAL
Molecular Formula C17H16ClNO3S
Molecular Weight 349.832
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cyclopropylmethyl 2-chloro-5-[[(2-methyl-3-furanyl)thioxomethyl]amino]benzoate

SMILES

CC1=C(C=CO1)C(=S)NC2=CC=C(Cl)C(=C2)C(=O)OCC3CC3

InChI

InChIKey=JFOJNMXPPYADJW-UHFFFAOYSA-N
InChI=1S/C17H16ClNO3S/c1-10-13(6-7-21-10)16(23)19-12-4-5-15(18)14(8-12)17(20)22-9-11-2-3-11/h4-8,11H,2-3,9H2,1H3,(H,19,23)

HIDE SMILES / InChI

Molecular Formula C17H16ClNO3S
Molecular Weight 349.832
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 12:46:01 GMT 2023
Edited
by admin
on Sat Dec 16 12:46:01 GMT 2023
Record UNII
M5ZJ3E4PBU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cyclopropylmethyl 2-chloro-5-[[(2-methyl-3-furanyl)thioxomethyl]amino]benzoate
Systematic Name English
NSC-638534
Code English
2-Chloro-5-((1-(2-methyl-furan-3-yl)-methanethioyl)-amino)-benzoic acid, cyclopropylmethyl ester
Common Name English
UC-70
Code English
Benzoic acid, 2-chloro-5-(((2-methyl-3-furanyl)thioxomethyl)amino)-, cyclopropylmethyl ester
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID00169505
Created by admin on Sat Dec 16 12:46:01 GMT 2023 , Edited by admin on Sat Dec 16 12:46:01 GMT 2023
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FDA UNII
M5ZJ3E4PBU
Created by admin on Sat Dec 16 12:46:01 GMT 2023 , Edited by admin on Sat Dec 16 12:46:01 GMT 2023
PRIMARY
NSC
638534
Created by admin on Sat Dec 16 12:46:01 GMT 2023 , Edited by admin on Sat Dec 16 12:46:01 GMT 2023
PRIMARY
PUBCHEM
3000930
Created by admin on Sat Dec 16 12:46:01 GMT 2023 , Edited by admin on Sat Dec 16 12:46:01 GMT 2023
PRIMARY
CAS
173046-05-4
Created by admin on Sat Dec 16 12:46:01 GMT 2023 , Edited by admin on Sat Dec 16 12:46:01 GMT 2023
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