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Details

Stereochemistry ACHIRAL
Molecular Formula C21H24N6O2
Molecular Weight 392.4543
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHYLBENZOPRIM

SMILES

CCN(CC1=CC=CC=C1)C2=C(C=C(C=C2)C3=C(CC)N=C(N)N=C3N)[N+]([O-])=O

InChI

InChIKey=IMIGOGRRRKKZEC-UHFFFAOYSA-N
InChI=1S/C21H24N6O2/c1-3-16-19(20(22)25-21(23)24-16)15-10-11-17(18(12-15)27(28)29)26(4-2)13-14-8-6-5-7-9-14/h5-12H,3-4,13H2,1-2H3,(H4,22,23,24,25)

HIDE SMILES / InChI

Molecular Formula C21H24N6O2
Molecular Weight 392.4543
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 12:42:04 GMT 2023
Edited
by admin
on Sat Dec 16 12:42:04 GMT 2023
Record UNII
F9736DF7CF
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ETHYLBENZOPRIM
Common Name English
6-ETHYL-5-(4-(ETHYL(PHENYLMETHYL)AMINO)-3-NITROPHENYL)-2,4-PYRIMIDINEDIAMINE
Systematic Name English
2,4-PYRIMIDINEDIAMINE, 6-ETHYL-5-(4-(ETHYL(PHENYLMETHYL)AMINO)-3-NITROPHENYL)-
Systematic Name English
NSC-382042
Code English
Code System Code Type Description
NSC
382042
Created by admin on Sat Dec 16 12:42:04 GMT 2023 , Edited by admin on Sat Dec 16 12:42:04 GMT 2023
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PUBCHEM
122668
Created by admin on Sat Dec 16 12:42:04 GMT 2023 , Edited by admin on Sat Dec 16 12:42:04 GMT 2023
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FDA UNII
F9736DF7CF
Created by admin on Sat Dec 16 12:42:04 GMT 2023 , Edited by admin on Sat Dec 16 12:42:04 GMT 2023
PRIMARY
CAS
118344-72-2
Created by admin on Sat Dec 16 12:42:04 GMT 2023 , Edited by admin on Sat Dec 16 12:42:04 GMT 2023
PRIMARY
EPA CompTox
DTXSID30152102
Created by admin on Sat Dec 16 12:42:04 GMT 2023 , Edited by admin on Sat Dec 16 12:42:04 GMT 2023
PRIMARY