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Details

Stereochemistry ACHIRAL
Molecular Formula C16H16N4O4S
Molecular Weight 360.388
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Bis(2-hydroxyethyl)amino-2-(5-nitro-2-thienyl)quinazoline

SMILES

OCCN(CCO)C1=NC(=NC2=CC=CC=C12)C3=CC=C(S3)[N+]([O-])=O

InChI

InChIKey=QPDGFLZXRKDMRL-UHFFFAOYSA-N
InChI=1S/C16H16N4O4S/c21-9-7-19(8-10-22)16-11-3-1-2-4-12(11)17-15(18-16)13-5-6-14(25-13)20(23)24/h1-6,21-22H,7-10H2

HIDE SMILES / InChI

Molecular Formula C16H16N4O4S
Molecular Weight 360.388
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 Fri Dec 15 16:41:37 GMT 2023
Edited
by admin
on Fri Dec 15 16:41:37 GMT 2023
Record UNII
CR22VVE8L4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Bis(2-hydroxyethyl)amino-2-(5-nitro-2-thienyl)quinazoline
Systematic Name English
2,2′-[[2-(5-Nitro-2-thienyl)-4-quinazolinyl]imino]bis[ethanol]
Systematic Name English
Nitro-2-thienyl)-4-quinazolinyl]imino]bis[ethanol], 2,2′-[[2-(5-
Systematic Name English
Ethanol, 2,2′-[[2-(5-nitro-2-thienyl)-4-quinazolinyl]imino]bis-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID3020176
Created by admin on Fri Dec 15 16:41:37 GMT 2023 , Edited by admin on Fri Dec 15 16:41:37 GMT 2023
PRIMARY
CAS
33372-39-3
Created by admin on Fri Dec 15 16:41:37 GMT 2023 , Edited by admin on Fri Dec 15 16:41:37 GMT 2023
PRIMARY
PUBCHEM
147528
Created by admin on Fri Dec 15 16:41:37 GMT 2023 , Edited by admin on Fri Dec 15 16:41:37 GMT 2023
PRIMARY
FDA UNII
CR22VVE8L4
Created by admin on Fri Dec 15 16:41:37 GMT 2023 , Edited by admin on Fri Dec 15 16:41:37 GMT 2023
PRIMARY