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Details

Stereochemistry ACHIRAL
Molecular Formula C26H34IN7O2
Molecular Weight 603.4983
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of I-APT

SMILES

NC1=C(I)C=C(C=C1)C(=O)NCCN\C(NC#N)=N\CCCOC2=CC=CC(CN3CCCCC3)=C2

InChI

InChIKey=VJTYCMQYDRXNNY-UHFFFAOYSA-N
InChI=1S/C26H34IN7O2/c27-23-17-21(8-9-24(23)29)25(35)30-11-12-32-26(33-19-28)31-10-5-15-36-22-7-4-6-20(16-22)18-34-13-2-1-3-14-34/h4,6-9,16-17H,1-3,5,10-15,18,29H2,(H,30,35)(H2,31,32,33)

HIDE SMILES / InChI

Molecular Formula C26H34IN7O2
Molecular Weight 603.4983
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:10:21 GMT 2023
Edited
by admin
on Sat Dec 16 20:10:21 GMT 2023
Record UNII
2RUE846VYC
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
I-APT
Common Name English
Benzamide, 4-amino-N-[2-[[(cyanoamino)[[3-[3-(1-piperidinylmethyl)phenoxy]propyl]imino]methyl]amino]ethyl]-3-iodo-
Systematic Name English
4-amino-N-{2-[(Z)-[(cyanoamino)[(3-{3-[(piperidin-1-yl)methyl]phenoxy}propyl)amino]methylidene]amino]ethyl}-3-iodobenzamide
Systematic Name English
4-Amino-N-[2-[[(cyanoamino)[[3-[3-(1-piperidinylmethyl)phenoxy]propyl]imino]methyl]amino]ethyl]-3-iodobenzamide
Systematic Name English
Benzamide, 4-amino-N-[2-[[(cyanoamino)[[3-[3-(1-piperidinylmethyl)phenoxy]propyl]amino]methylene]amino]ethyl]-3-iodo-
Systematic Name English
Iodoaminopotentidine
Common Name English
Code System Code Type Description
CAS
126632-01-7
Created by admin on Sat Dec 16 20:10:22 GMT 2023 , Edited by admin on Sat Dec 16 20:10:22 GMT 2023
PRIMARY
PUBCHEM
181461
Created by admin on Sat Dec 16 20:10:22 GMT 2023 , Edited by admin on Sat Dec 16 20:10:22 GMT 2023
PRIMARY
FDA UNII
2RUE846VYC
Created by admin on Sat Dec 16 20:10:22 GMT 2023 , Edited by admin on Sat Dec 16 20:10:22 GMT 2023
PRIMARY
Related Record Type Details
LABELED -> NON-LABELED