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Details

Stereochemistry ACHIRAL
Molecular Formula C47H29Cl4N7O5
Molecular Weight 913.589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 4-[2-(2,5-Dichlorophenyl)diazenyl]-N-[4-[[4-[[[4-[2-(2,5-dichlorophenyl)diazenyl]-3-hydroxy-2-naphthalenyl]carbonyl]amino]benzoyl]amino]phenyl]-3-hydroxy-2-naphthalenecarboxamide

SMILES

OC1=C(\N=N\C2=C(Cl)C=CC(Cl)=C2)C3=C(C=CC=C3)C=C1C(=O)NC4=CC=C(NC(=O)C5=CC=C(NC(=O)C6=CC7=C(C=CC=C7)C(\N=N\C8=C(Cl)C=CC(Cl)=C8)=C6O)C=C5)C=C4

InChI

InChIKey=KBJVUVWQWIQQPG-NCCSDIRBSA-N
InChI=1S/C47H29Cl4N7O5/c48-28-11-19-37(50)39(23-28)55-57-41-33-7-3-1-5-26(33)21-35(43(41)59)46(62)53-30-13-9-25(10-14-30)45(61)52-31-15-17-32(18-16-31)54-47(63)36-22-27-6-2-4-8-34(27)42(44(36)60)58-56-40-24-29(49)12-20-38(40)51/h1-24,59-60H,(H,52,61)(H,53,62)(H,54,63)/b57-55+,58-56+

HIDE SMILES / InChI

Approval Year

Name Type Language
4-[2-(2,5-Dichlorophenyl)diazenyl]-N-[4-[[4-[[[4-[2-(2,5-dichlorophenyl)diazenyl]-3-hydroxy-2-naphthalenyl]carbonyl]amino]benzoyl]amino]phenyl]-3-hydroxy-2-naphthalenecarboxamide
Systematic Name English
2-Naphthalenecarboxamide, 4-[2-(2,5-dichlorophenyl)diazenyl]-N-[4-[[4-[[[4-[2-(2,5-dichlorophenyl)diazenyl]-3-hydroxy-2-naphthalenyl]carbonyl]amino]benzoyl]amino]phenyl]-3-hydroxy-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID9072650
Created by admin on Sat Dec 16 12:24:51 GMT 2023 , Edited by admin on Sat Dec 16 12:24:51 GMT 2023
PRIMARY
CAS
72927-73-2
Created by admin on Sat Dec 16 12:24:51 GMT 2023 , Edited by admin on Sat Dec 16 12:24:51 GMT 2023
PRIMARY
FDA UNII
MK7EA3A75Q
Created by admin on Sat Dec 16 12:24:51 GMT 2023 , Edited by admin on Sat Dec 16 12:24:51 GMT 2023
PRIMARY
ECHA (EC/EINECS)
277-021-9
Created by admin on Sat Dec 16 12:24:51 GMT 2023 , Edited by admin on Sat Dec 16 12:24:51 GMT 2023
PRIMARY