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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N2O4S
Molecular Weight 330.358
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-Amino-2-((4-methylphenyl)sulfonyl)-4-phenyl-5(2H)-isoxazolone

SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2OC(=O)C(=C2N)C3=CC=CC=C3

InChI

InChIKey=PSOMITOELGTSMR-UHFFFAOYSA-N
InChI=1S/C16H14N2O4S/c1-11-7-9-13(10-8-11)23(20,21)18-15(17)14(16(19)22-18)12-5-3-2-4-6-12/h2-10H,17H2,1H3

HIDE SMILES / InChI

Molecular Formula C16H14N2O4S
Molecular Weight 330.358
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 12:55:27 GMT 2023
Edited
by admin
on Sat Dec 16 12:55:27 GMT 2023
Record UNII
ZZ4RA7XYZ4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Amino-2-((4-methylphenyl)sulfonyl)-4-phenyl-5(2H)-isoxazolone
Systematic Name English
5(2H)-Isoxazolone, 3-amino-2-[(4-methylphenyl)sulfonyl]-4-phenyl-
Systematic Name English
NSC-65739
Code English
3-Amino-2-(4-methylphenyl)sulfonyl-4-phenyl-1,2-oxazol-5-one
Systematic Name English
Code System Code Type Description
NSC
65739
Created by admin on Sat Dec 16 12:55:27 GMT 2023 , Edited by admin on Sat Dec 16 12:55:27 GMT 2023
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FDA UNII
ZZ4RA7XYZ4
Created by admin on Sat Dec 16 12:55:27 GMT 2023 , Edited by admin on Sat Dec 16 12:55:27 GMT 2023
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PUBCHEM
248523
Created by admin on Sat Dec 16 12:55:27 GMT 2023 , Edited by admin on Sat Dec 16 12:55:27 GMT 2023
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EPA CompTox
DTXSID00219736
Created by admin on Sat Dec 16 12:55:27 GMT 2023 , Edited by admin on Sat Dec 16 12:55:27 GMT 2023
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CAS
6950-33-0
Created by admin on Sat Dec 16 12:55:27 GMT 2023 , Edited by admin on Sat Dec 16 12:55:27 GMT 2023
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