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Details

Stereochemistry ACHIRAL
Molecular Formula C32H37Cl2N7
Molecular Weight 590.589
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-BIS(2-CHLOROETHYL)-4-(6-(3-(6-(4-METHYLPIPERAZIN-1-YL)-1H-BENZIMIDAZOL-2-YL)PROPYL)-1H-BENZIMIDAZOL-2-YL)ANILINE

SMILES

CN1CCN(CC1)C2=CC=C3N=C(CCCC4=CC=C5NC(=NC5=C4)C6=CC=C(C=C6)N(CCCl)CCCl)NC3=C2

InChI

InChIKey=RDZLKXCXRNVKER-UHFFFAOYSA-N
InChI=1S/C32H37Cl2N7/c1-39-17-19-41(20-18-39)26-10-12-27-30(22-26)36-31(35-27)4-2-3-23-5-11-28-29(21-23)38-32(37-28)24-6-8-25(9-7-24)40(15-13-33)16-14-34/h5-12,21-22H,2-4,13-20H2,1H3,(H,35,36)(H,37,38)

HIDE SMILES / InChI

Molecular Formula C32H37Cl2N7
Molecular Weight 590.589
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 Mon Mar 31 22:29:54 GMT 2025
Edited
by admin
on Mon Mar 31 22:29:54 GMT 2025
Record UNII
M7SV3UGM9O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-BIS(2-CHLOROETHYL)-4-(6-(3-(6-(4-METHYLPIPERAZIN-1-YL)-1H-BENZIMIDAZOL-2-YL)PROPYL)-1H-BENZIMIDAZOL-2-YL)ANILINE
Systematic Name English
BENZENAMINE, N,N-BIS(2-CHLOROETHYL)-4-(6-(3-(6-(4-METHYL-1-PIPERAZINYL)-1H-BENZIMIDAZOL-2-YL)PROPYL)-1H-BENZIMIDAZOL-2-YL)-BIS(2-CHLOROETHYL)AMINE
Preferred Name English
N,N-BIS(2-CHLOROETHYL)-4-(6-(3-(6-(4-METHYL-1-PIPERAZINYL)-1H-BENZIMIDAZOL-2-YL)PROPYL)-1H-BENZIMIDAZOL-2-YL)BENZENAMINE
Systematic Name English
Code System Code Type Description
CAS
166546-22-1
Created by admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
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FDA UNII
M7SV3UGM9O
Created by admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
PRIMARY
EPA CompTox
DTXSID70168126
Created by admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
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PUBCHEM
154805
Created by admin on Mon Mar 31 22:29:54 GMT 2025 , Edited by admin on Mon Mar 31 22:29:54 GMT 2025
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