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Details

Stereochemistry ACHIRAL
Molecular Formula C18H19N5O3S
Molecular Weight 385.44
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 2-(ETHYL(3-METHYL-4-((5-NITRO-2,1-BENZISOTHIAZOL-3-YL)AZO)PHENYL)AMINO)ETHANOL

SMILES

CCN(CCO)C1=CC=C(\N=N\C2=C3C=C(C=CC3=NS2)[N+]([O-])=O)C(C)=C1

InChI

InChIKey=CEYYUMLIVMNONK-FMQUCBEESA-N
InChI=1S/C18H19N5O3S/c1-3-22(8-9-24)13-4-6-16(12(2)10-13)19-20-18-15-11-14(23(25)26)5-7-17(15)21-27-18/h4-7,10-11,24H,3,8-9H2,1-2H3/b20-19+

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2-(ETHYL(3-METHYL-4-((5-NITRO-2,1-BENZISOTHIAZOL-3-YL)AZO)PHENYL)AMINO)ETHANOL
Systematic Name English
ETHANOL, 2-(ETHYL(3-METHYL-4-((5-NITRO-2,1-BENZISOTHIAZOL-3-YL)AZO)PHENYL)AMINO)-
Preferred Name English
ETHANOL, 2-(ETHYL(3-METHYL-4-(2-(5-NITRO-2,1-BENZISOTHIAZOL-3-YL)DIAZENYL)PHENYL)AMINO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
16205614
Created by admin on Mon Mar 31 23:21:49 GMT 2025 , Edited by admin on Mon Mar 31 23:21:49 GMT 2025
PRIMARY
ECHA (EC/EINECS)
286-875-1
Created by admin on Mon Mar 31 23:21:49 GMT 2025 , Edited by admin on Mon Mar 31 23:21:49 GMT 2025
PRIMARY
FDA UNII
YD24MK0JPV
Created by admin on Mon Mar 31 23:21:49 GMT 2025 , Edited by admin on Mon Mar 31 23:21:49 GMT 2025
PRIMARY
CAS
85392-17-2
Created by admin on Mon Mar 31 23:21:49 GMT 2025 , Edited by admin on Mon Mar 31 23:21:49 GMT 2025
PRIMARY
NIH
NCATS
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