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

Details

Stereochemistry ACHIRAL
Molecular Formula C21H25Cl2N3O
Molecular Weight 406.349
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACRIDINE MUSTARD FREE BASE

SMILES

CCN(CCCl)CCCNC1=C2C=CC(Cl)=CC2=NC3=C1C=C(OC)C=C3

InChI

InChIKey=OIFINQAUHKZSBV-UHFFFAOYSA-N
InChI=1S/C21H25Cl2N3O/c1-3-26(12-9-22)11-4-10-24-21-17-7-5-15(23)13-20(17)25-19-8-6-16(27-2)14-18(19)21/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,24,25)

HIDE SMILES / InChI

Molecular Formula C21H25Cl2N3O
Molecular Weight 406.349
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Differential mutant quantitation at the mouse lymphoma tk and CHO hgprt loci.
1989 Sep
Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:17:45 UTC 2023
Edited
by admin
on Sat Dec 16 09:17:45 UTC 2023
Record UNII
568MU7Q5YZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACRIDINE MUSTARD FREE BASE
Common Name English
ICR-170 FREE BASE
Code English
1,3-PROPANEDIAMINE, N-(2-CHLOROETHYL)-N'-(6-CHLORO-2-METHOXY-9-ACRIDINYL)-N-ETHYL-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID50156369
Created by admin on Sat Dec 16 09:17:45 UTC 2023 , Edited by admin on Sat Dec 16 09:17:45 UTC 2023
PRIMARY
PUBCHEM
8972
Created by admin on Sat Dec 16 09:17:45 UTC 2023 , Edited by admin on Sat Dec 16 09:17:45 UTC 2023
PRIMARY
CAS
13015-79-7
Created by admin on Sat Dec 16 09:17:45 UTC 2023 , Edited by admin on Sat Dec 16 09:17:45 UTC 2023
PRIMARY
FDA UNII
568MU7Q5YZ
Created by admin on Sat Dec 16 09:17:45 UTC 2023 , Edited by admin on Sat Dec 16 09:17:45 UTC 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT