N,N-Bis(2-chloroethyl)-4-[6-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]benzenamine

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H33Cl2N7
Molecular Weight	562.536
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-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]benzenamine

Structure Search

SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)N=C(CC4=CC5=C(NC(=N5)C6=CC=C(C=C6)N(CCCl)CCCl)C=C4)N3

InChI

InChIKey=RCSQPIRTROVFNF-UHFFFAOYSA-N

InChI=1S/C30H33Cl2N7/c1-37-14-16-39(17-15-37)24-7-9-25-28(20-24)34-29(33-25)19-21-2-8-26-27(18-21)36-30(35-26)22-3-5-23(6-4-22)38(12-10-31)13-11-32/h2-9,18,20H,10-17,19H2,1H3,(H,33,34)(H,35,36)

HIDE SMILES / InChI

Molecular Formula	C30H33Cl2N7
Molecular Weight	562.536
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 `Sat Dec 16 09:06:21 GMT 2023` Edited by `admin` on `Sat Dec 16 09:06:21 GMT 2023`
Record UNII	ZML82D2FY8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

N,N-Bis(2-chloroethyl)-4-[6-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]benzenamine

Systematic Name

English

Benzenamine, N,N-bis(2-chloroethyl)-4-[5-[[5-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]-

Systematic Name

English

Benzenamine, N,N-bis(2-chloroethyl)-4-[6-[[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]methyl]-1H-benzimidazol-2-yl]-

Systematic Name

English

Code System Code Type Description

FDA UNII

ZML82D2FY8

Created by admin on Sat Dec 16 09:06:21 GMT 2023 , Edited by admin on Sat Dec 16 09:06:21 GMT 2023

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PUBCHEM

154803

Created by admin on Sat Dec 16 09:06:21 GMT 2023 , Edited by admin on Sat Dec 16 09:06:21 GMT 2023

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EPA CompTox

DTXSID50168124

Created by admin on Sat Dec 16 09:06:21 GMT 2023 , Edited by admin on Sat Dec 16 09:06:21 GMT 2023

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CAS

166546-20-9

Created by admin on Sat Dec 16 09:06:21 GMT 2023 , Edited by admin on Sat Dec 16 09:06:21 GMT 2023

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