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

Details

Stereochemistry ACHIRAL
Molecular Formula C32H34N4O3
Molecular Weight 522.6374
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-[2-[2-(Acetylamino)phenyl]ethyl]-4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-1-oxo-2-naphthalenecarboxamide

SMILES

CCN(CC)C1=CC(C)=C(C=C1)\N=C2/C=C(C(=O)NCCC3=C(NC(C)=O)C=CC=C3)C(=O)C4=CC=CC=C24

InChI

InChIKey=XFESIBWPGWHDKC-WUZYOQQESA-N
InChI=1S/C32H34N4O3/c1-5-36(6-2)24-15-16-28(21(3)19-24)35-30-20-27(31(38)26-13-9-8-12-25(26)30)32(39)33-18-17-23-11-7-10-14-29(23)34-22(4)37/h7-16,19-20H,5-6,17-18H2,1-4H3,(H,33,39)(H,34,37)/b35-30+

HIDE SMILES / InChI

Approval Year

Name Type Language
N-[2-[2-(Acetylamino)phenyl]ethyl]-4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-1-oxo-2-naphthalenecarboxamide
Systematic Name English
2-Naphthalenecarboxamide, N-[2-[2-(acetylamino)phenyl]ethyl]-4-[[4-(diethylamino)-2-methylphenyl]imino]-1,4-dihydro-1-oxo-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID7069659
Created by admin on Sat Dec 16 20:01:09 GMT 2023 , Edited by admin on Sat Dec 16 20:01:09 GMT 2023
PRIMARY
CAS
63059-58-5
Created by admin on Sat Dec 16 20:01:09 GMT 2023 , Edited by admin on Sat Dec 16 20:01:09 GMT 2023
PRIMARY
FDA UNII
TW5YX65SXP
Created by admin on Sat Dec 16 20:01:09 GMT 2023 , Edited by admin on Sat Dec 16 20:01:09 GMT 2023
PRIMARY
ECHA (EC/EINECS)
263-827-8
Created by admin on Sat Dec 16 20:01:09 GMT 2023 , Edited by admin on Sat Dec 16 20:01:09 GMT 2023
PRIMARY