WMC-50

Details

Stereochemistry	ACHIRAL
Molecular Formula	C37H35N9O2
Molecular Weight	637.7329
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

O=C1C2=C(C=CC=C2)N3C=NC4=CC=C(NCCCN5CCN(CCCNC6=CC=C7N=NN8C7=C6C(=O)C9=C8C=CC=C9)CC5)C1=C34

InChI

InChIKey=MQFWSJLJVULXGV-UHFFFAOYSA-N

InChI=1S/C37H35N9O2/c47-36-24-7-1-3-9-30(24)45-23-40-28-13-11-26(32(36)34(28)45)38-15-5-17-43-19-21-44(22-20-43)18-6-16-39-27-12-14-29-35-33(27)37(48)25-8-2-4-10-31(25)46(35)42-41-29/h1-4,7-14,23,38-39H,5-6,15-22H2

HIDE SMILES / InChI

Molecular Formula	C37H35N9O2
Molecular Weight	637.7329
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 `Tue Apr 01 19:37:50 GMT 2025` Edited by `admin` on `Tue Apr 01 19:37:50 GMT 2025`
Record UNII	2Y3WVU2DZ2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

WMC-50

Code

English

NSC-682404

Preferred Name

English

6H-(1,2,3)TRIAZOLO(4,5,1-DE)ACRIDIN-6-ONE, 5-((3-(4-(3-((6-OXO-6H-IMIDAZO(4,5,1-DE)ACRIDIN-5-YL)AMINO)PROPYL)-1-PIPERAZINYL)PROPYL)AMINO)-

Systematic Name

English

WMC50

Code

English

5-[[3-[4-[3-[(6-Oxo-6H-imidazo[4,5,1-de]acridin-5-yl)amino]propyl]-1-piperazinyl]propyl]amino]-6H-[1,2,3]triazolo[4,5,1-de]acridin-6-one

Systematic Name

English

Code System Code Type Description

CAS

197903-13-2