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

Details

Stereochemistry ACHIRAL
Molecular Formula C26H25N7O2
Molecular Weight 467.5224
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzamide, N-(4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)-3-((((4-(aminothioxomethyl)phenyl)amino)carbonyl)amino)-

SMILES

O=C(NC1=CC=C(C=C1)C2=NCCN2)NC3=CC=CC(=C3)C(=O)NC4=CC=C(C=C4)C5=NCCN5

InChI

InChIKey=VXIUBJJSQYFWCA-UHFFFAOYSA-N
InChI=1S/C26H25N7O2/c34-25(31-20-8-4-17(5-9-20)23-27-12-13-28-23)19-2-1-3-22(16-19)33-26(35)32-21-10-6-18(7-11-21)24-29-14-15-30-24/h1-11,16H,12-15H2,(H,27,28)(H,29,30)(H,31,34)(H2,32,33,35)

HIDE SMILES / InChI

Molecular Formula C26H25N7O2
Molecular Weight 467.5224
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 12:45:42 GMT 2023
Edited
by admin
on Sat Dec 16 12:45:42 GMT 2023
Record UNII
879VX58ZF7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Benzamide, N-(4-(4,5-dihydro-1H-imidazol-2-yl)phenyl)-3-((((4-(aminothioxomethyl)phenyl)amino)carbonyl)amino)-
Systematic Name English
NSC-63690
Code English
N-[4-(4,5-Dihydro-1H-imidazol-2-yl)phenyl]-3-[[[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]amino]carbonyl]amino]benzamide
Systematic Name English
Benzamide, N-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-3-[[[[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]amino]carbonyl]amino]-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30200374
Created by admin on Sat Dec 16 12:45:42 GMT 2023 , Edited by admin on Sat Dec 16 12:45:42 GMT 2023
PRIMARY
FDA UNII
879VX58ZF7
Created by admin on Sat Dec 16 12:45:42 GMT 2023 , Edited by admin on Sat Dec 16 12:45:42 GMT 2023
PRIMARY
PUBCHEM
247952
Created by admin on Sat Dec 16 12:45:42 GMT 2023 , Edited by admin on Sat Dec 16 12:45:42 GMT 2023
PRIMARY
CAS
5235-43-8
Created by admin on Sat Dec 16 12:45:42 GMT 2023 , Edited by admin on Sat Dec 16 12:45:42 GMT 2023
PRIMARY
NSC
63690
Created by admin on Sat Dec 16 12:45:42 GMT 2023 , Edited by admin on Sat Dec 16 12:45:42 GMT 2023
PRIMARY