U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H12ClN5O4S
Molecular Weight 405.816
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 6-Amino-5-[(2-chloro-4-nitrophenyl)azo]naphthalene-1-sulfonamide

SMILES

NC1=C(\N=N\C2=CC=C(C=C2Cl)[N+]([O-])=O)C3=CC=CC(=C3C=C1)S(N)(=O)=O

InChI

InChIKey=QWMXREGTJHCYOA-QZQOTICOSA-N
InChI=1S/C16H12ClN5O4S/c17-12-8-9(22(23)24)4-7-14(12)20-21-16-11-2-1-3-15(27(19,25)26)10(11)5-6-13(16)18/h1-8H,18H2,(H2,19,25,26)/b21-20+

HIDE SMILES / InChI

Molecular Formula C16H12ClN5O4S
Molecular Weight 405.816
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:58:01 GMT 2023
Edited
by admin
on Sat Dec 16 11:58:01 GMT 2023
Record UNII
96YJD2PDR4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-Amino-5-[(2-chloro-4-nitrophenyl)azo]naphthalene-1-sulfonamide
Systematic Name English
6-Amino-5-[2-(2-chloro-4-nitrophenyl)diazenyl]-1-naphthalenesulfonamide
Systematic Name English
1-Naphthalenesulfonamide, 6-amino-5-[(2-chloro-4-nitrophenyl)azo]-
Systematic Name English
1-Naphthalenesulfonamide, 6-amino-5-[2-(2-chloro-4-nitrophenyl)diazenyl]-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
223-396-9
Created by admin on Sat Dec 16 11:58:01 GMT 2023 , Edited by admin on Sat Dec 16 11:58:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID7063215
Created by admin on Sat Dec 16 11:58:01 GMT 2023 , Edited by admin on Sat Dec 16 11:58:01 GMT 2023
PRIMARY
FDA UNII
96YJD2PDR4
Created by admin on Sat Dec 16 11:58:01 GMT 2023 , Edited by admin on Sat Dec 16 11:58:01 GMT 2023
PRIMARY
CAS
3874-84-8
Created by admin on Sat Dec 16 11:58:01 GMT 2023 , Edited by admin on Sat Dec 16 11:58:01 GMT 2023
PRIMARY