2-(3-{4-[3-chloro-4-(1-{2-chloro-4-[4-(3-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}propyl)piperazin-1-yl]phenyl}ethyl)phenyl]piperazin-1-yl}propyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one

Details

Stereochemistry	ACHIRAL
Molecular Formula	C40H46Cl2N10O2
Molecular Weight	769.765
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-(3-{4-[3-chloro-4-(1-{2-chloro-4-[4-(3-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}propyl)piperazin-1-yl]phenyl}ethyl)phenyl]piperazin-1-yl}propyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one

Structure Search

SMILES

CC(C1=C(Cl)C=C(C=C1)N2CCN(CCCN3N=C4C=CC=CN4C3=O)CC2)C5=C(Cl)C=C(C=C5)N6CCN(CCCN7N=C8C=CC=CN8C7=O)CC6

InChI

InChIKey=IECYGHCIBUXYPX-UHFFFAOYSA-N

InChI=1S/C40H46Cl2N10O2/c1-30(33-12-10-31(28-35(33)41)47-24-20-45(21-25-47)14-6-18-51-39(53)49-16-4-2-8-37(49)43-51)34-13-11-32(29-36(34)42)48-26-22-46(23-27-48)15-7-19-52-40(54)50-17-5-3-9-38(50)44-52/h2-5,8-13,16-17,28-30H,6-7,14-15,18-27H2,1H3

HIDE SMILES / InChI

Molecular Formula	C40H46Cl2N10O2
Molecular Weight	769.765
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 19:21:11 GMT 2023` Edited by `admin` on `Sat Dec 16 19:21:11 GMT 2023`
Record UNII	6CD74RCU47
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-(3-{4-[3-chloro-4-(1-{2-chloro-4-[4-(3-{3-oxo-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-2-yl}propyl)piperazin-1-yl]phenyl}ethyl)phenyl]piperazin-1-yl}propyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one

Systematic Name

English

Code System Code Type Description

PUBCHEM

166177254

Created by admin on Sat Dec 16 19:21:11 GMT 2023 , Edited by admin on Sat Dec 16 19:21:11 GMT 2023

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CAS

2727463-29-6

Created by admin on Sat Dec 16 19:21:11 GMT 2023 , Edited by admin on Sat Dec 16 19:21:11 GMT 2023

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FDA UNII

6CD74RCU47

Created by admin on Sat Dec 16 19:21:11 GMT 2023 , Edited by admin on Sat Dec 16 19:21:11 GMT 2023

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