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Details

Stereochemistry ACHIRAL
Molecular Formula C27H26N6O2S
Molecular Weight 498.599
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N(1),N(4)-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-(METHYLTHIO)TEREPHTHALAMIDE

SMILES

CSC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NCCN3)C(=O)NC4=CC=C(C=C4)C5=NCCN5

InChI

InChIKey=IDDODVNWHPPDDC-UHFFFAOYSA-N
InChI=1S/C27H26N6O2S/c1-36-23-16-19(26(34)32-20-7-2-17(3-8-20)24-28-12-13-29-24)6-11-22(23)27(35)33-21-9-4-18(5-10-21)25-30-14-15-31-25/h2-11,16H,12-15H2,1H3,(H,28,29)(H,30,31)(H,32,34)(H,33,35)

HIDE SMILES / InChI

Molecular Formula C27H26N6O2S
Molecular Weight 498.599
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 12:54:20 GMT 2023
Edited
by admin
on Sat Dec 16 12:54:20 GMT 2023
Record UNII
J363HW2C0M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N(1),N(4)-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-(METHYLTHIO)TEREPHTHALAMIDE
Systematic Name English
1,4-BENZENEDICARBOXAMIDE, N,N'-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-(METHYLTHIO)-
Systematic Name English
NSC-72382
Code English
N1,N4-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-(METHYLTHIO)-1,4-BENZENEDICARBOXAMIDE
Systematic Name English
1,4-BENZENEDICARBOXAMIDE, N1,N4-BIS(4-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENYL)-2-(METHYLTHIO)-
Systematic Name English
TEREPHTHALANILIDE, 4',4''-DI-2-IMIDAZOLIN-2-YL-2-(METHYLTHIO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
251711
Created by admin on Sat Dec 16 12:54:20 GMT 2023 , Edited by admin on Sat Dec 16 12:54:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID30176080
Created by admin on Sat Dec 16 12:54:20 GMT 2023 , Edited by admin on Sat Dec 16 12:54:20 GMT 2023
PRIMARY
NSC
72382
Created by admin on Sat Dec 16 12:54:20 GMT 2023 , Edited by admin on Sat Dec 16 12:54:20 GMT 2023
PRIMARY
CAS
21696-24-2
Created by admin on Sat Dec 16 12:54:20 GMT 2023 , Edited by admin on Sat Dec 16 12:54:20 GMT 2023
PRIMARY
FDA UNII
J363HW2C0M
Created by admin on Sat Dec 16 12:54:20 GMT 2023 , Edited by admin on Sat Dec 16 12:54:20 GMT 2023
PRIMARY